1034747 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 8 8 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 4 5 5 5 6 6 6 7 7 8 9 9 10 10 11 11 11 12 12 12 15 15 16 17 18 19 19 20 20 21 21 22 22 23 23 24 24 25 26 27 27 27 28 28 28 17 27 18 28 13 14 7 13 29 8 14 30 8 9 10 15 31 16 32 13 17 19 14 18 20 16 33 34 21 22 23 35 24 36 25 37 26 38 25 39 26 40 41 42 43 44 45 46 47 48 1 1 1 1 2 2 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 2 1 1 2 2 1 1 2 2 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 4.5981 9.7942 4.5981 8.9282 5.4641 7.1962 6.3301 7.1962 6.3301 8.0622 3.732 8.0622 4.5981 8.0622 7.1962 8.0622 3.732 8.9282 2.866 7.1962 2.866 8.9282 2 7.1962 2 8.0622 4.5981 10.6603 5.4641 6.6592 5.7932 8.5991 7.1962 8.5991 2.866 6.6592 2.866 9.4651 1.4631 6.6592 1.4631 8.0622 5.2181 4.5981 3.9781 10.9703 11.1972 10.3503 0.25 1.25 -2.75 -0.25 -1.25 -0.25 -1.75 -1.25 -2.75 -1.75 -1.25 1.25 -1.75 0.25 -3.25 -2.75 -0.25 1.75 -1.75 1.75 0.25 2.75 -1.25 2.75 -0.25 3.25 1.25 1.75 -0.63 0.06 -3.06 -1.44 -3.87 -3.06 -2.37 1.44 0.87 3.06 -1.56 3.06 0.06 3.87 1.25 1.87 1.25 1.2131 2.06 2.2869 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 7 7 8 9 10 11 11 12 12 15 17 18 19 20 21 22 23 24 8 9 10 15 16 17 19 18 20 16 21 22 23 24 25 26 25 26 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 481 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 6 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371E07B38000000000000000000000000000000000000003060C0000000000000015000001E00100000000C0C81980232C682C00400880225525000820800252200088801067CC80C6636C4B59B94316866F411C8E98798C8208E00000000000800200000000000100040000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-N-[2-[(2-methoxybenzoyl)amino]phenyl]benzamide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-N-[2-[[(2-methoxyphenyl)-oxomethyl]amino]phenyl]benzamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-<I>N</I>-[2-[(2-methoxybenzoyl)amino]phenyl]benzamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-N-[2-[(2-methoxybenzoyl)amino]phenyl]benzamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-N-[2-[(2-methoxyphenyl)carbonylamino]phenyl]benzamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-methoxy-N-[2-(o-anisoylamino)phenyl]benzamide InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C22H20N2O4/c1-27-19-13-7-3-9-15(19)21(25)23-17-11-5-6-12-18(17)24-22(26)16-10-4-8-14-20(16)28-2/h3-14H,1-2H3,(H,23,25)(H,24,26) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 BUXZWHPUDAPMKC-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 3.5 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 376.14230712 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C22H20N2O4 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 376.4 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 COC1=CC=CC=C1C(=O)NC2=CC=CC=C2NC(=O)C3=CC=CC=C3OC SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 COC1=CC=CC=C1C(=O)NC2=CC=CC=C2NC(=O)C3=CC=CC=C3OC Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 76.7 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 376.14230712 28 0 0 0 0 0 0 0 1 -1