8030390 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 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 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 7 7 7 8 9 9 10 10 11 11 12 13 13 14 15 15 15 17 17 17 18 18 18 19 19 19 21 22 22 23 23 24 24 25 8 16 12 19 16 20 20 21 39 21 25 8 9 13 10 11 15 12 17 16 18 14 14 26 27 28 29 30 31 32 33 34 35 36 20 37 38 22 23 40 24 41 25 42 43 1 1 1 1 2 2 1 1 1 1 2 2 1 1 1 2 1 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 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 10.7262 7.1961 12.4583 5.4679 4.5961 3.7359 9.8602 9.8602 10.7262 8.9663 11.5923 8.0602 8.9663 8.0602 10.7262 11.5923 8.9778 12.4583 6.3282 5.4641 3.732 2.8641 2 2.0038 2.8718 8.9734 7.5245 11.3462 10.7262 10.1062 8.3579 8.985 9.5978 12.7683 12.9952 12.1483 6.7249 5.9278 4.5937 2.8617 1.4619 1.4681 2.8742 -0.7296 -0.7537 -0.7296 -1.7604 -0.2638 -1.7671 0.7704 -0.2296 1.2704 -0.7642 0.7704 -0.2504 1.3051 0.7912 2.2704 -0.2296 -1.7642 1.2704 -0.2571 -0.7604 -0.7671 -0.2704 -0.7738 -1.7738 -2.2704 1.925 1.1033 2.2704 2.8904 2.2704 -1.7714 -2.3841 -1.757 0.7335 1.5804 1.8074 0.2194 0.2163 0.3562 0.3496 -0.4658 -2.0858 -2.8904 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 1 1 6 6 7 7 7 8 9 10 11 12 13 21 22 23 24 8 16 21 25 8 9 13 10 11 12 16 14 14 22 23 24 25 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 560 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 5 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 4 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371E07B38000000000000000000000000000000000000003C408000000000000081C000001E00100000000C04E19A063FBE92C81400A80233F77C0282882931222009D8217E6CD88E27E2C4B99F873A28EDD517D8E92790E0EC0E20000208000800004000041000100000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 N-(2-pyridyl)-2-(3,4,8-trimethyl-2-oxo-chromen-7-yl)oxy-acetamide IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 N-(2-pyridinyl)-2-[(3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl)oxy]acetamide IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 <I>N</I>-pyridin-2-yl-2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetamide IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 N-pyridin-2-yl-2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetamide IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 N-pyridin-2-yl-2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxy-ethanamide IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 2-(2-keto-3,4,8-trimethyl-chromen-7-yl)oxy-N-(2-pyridyl)acetamide InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C19H18N2O4/c1-11-12(2)19(23)25-18-13(3)15(8-7-14(11)18)24-10-17(22)21-16-6-4-5-9-20-16/h4-9H,10H2,1-3H3,(H,20,21,22) InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 IIXINRDIZCADGQ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 2.7 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 338.12665706 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C19H18N2O4 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 338.4 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NC3=CC=CC=N3)C SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NC3=CC=CC=N3)C Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 77.5 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 338.12665706 25 0 0 0 0 0 0 0 1 -1