methyl (11E)-11-[2-[5-[oxidanyl(phenyl)methyl]benzimidazol-1-yl]ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl (11E)-11-[2-[5-[oxidanyl(phenyl)methyl]benzimidazol-1-yl]ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl (11E)-11-[2-[5-[hydroxy(phenyl)methyl]benzimidazol-1-yl]ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[2-[5-[hydroxy(phenyl)methyl]-1-benzimidazolyl]ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl (11E)-11-[2-[5-[hydroxy(phenyl)methyl]benzimidazol-1-yl]ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[2-[5-[hydroxy(phenyl)methyl]benzimidazol-1-yl]ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C32H26N2O4 MolecularWeight: 502.55984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=CCN4C=NC5=C4C=CC(=C5)C(C6=CC=CC=C6)O

Isomeric SMILES

COC(=O)C1=CC\2=C(C=C1)OCC3=CC=CC=C3/C2=C\CN4C=NC5=C4C=CC(=C5)C(C6=CC=CC=C6)O

InChI

InChI=1S/C32H26N2O4/c1-37-32(36)23-12-14-30-27(17-23)26(25-10-6-5-9-24(25)19-38-30)15-16-34-20-33-28-18-22(11-13-29(28)34)31(35)21-7-3-2-4-8-21/h2-15,17-18,20,31,35H,16,19H2,1H3/b26-15+