5356785 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 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 2 2 2 3 3 4 5 5 6 6 7 7 8 8 9 9 10 10 11 11 12 12 13 14 3 5 7 4 6 8 4 15 16 9 17 10 18 11 19 12 20 13 21 14 22 13 23 14 24 25 26 1 2 1 1 2 1 2 1 1 1 1 1 1 2 1 2 1 2 1 2 1 1 1 1 1 1 1 3 1 15 4 2 16 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 2.866 4.5981 2.866 3.732 2 4.5981 3.732 5.4641 2 5.4641 3.732 6.3301 2.866 6.3301 2.3291 3.732 1.4631 4.0611 4.269 5.4641 1.4631 5.4641 4.269 6.8671 2.866 6.8671 -0.06 0.94 0.94 1.44 -0.56 -0.06 -0.56 1.44 -1.56 -0.56 -1.56 0.94 -2.06 -0.06 1.25 2.06 -0.25 -0.37 -0.25 2.06 -1.87 -1.18 -1.87 1.25 -2.68 -0.37 8 8 8 8 8 8 8 8 8 8 8 8 1 1 2 2 5 6 7 8 9 10 11 12 5 7 6 8 9 10 11 12 13 14 13 14 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 149 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371C0700000000000000000000000000000000000000000306000000000000000014000001800000000000C008018003000800000008002204200000200002000000888000000880820228011108020002080000888070080000E00000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 (Z)-stilbene IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 (Z)-stilbene IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 (Z)-stilbene IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 (Z)-stilbene IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(Z)-2-phenylethenyl]benzene IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 (Z)-stilbene InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11- InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 PJANXHGTPQOBST-QXMHVHEDSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2021.10.14 4.8 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 180.093900383 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C14H12 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 180.24 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)C=CC2=CC=CC=C2 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)/C=C\C2=CC=CC=C2 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 180.093900383 14 0 0 0 1 1 0 0 1 -1