(11E)-11-[2-(4,7-dimethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylic acid

Systemtic Name: (11E)-11-[2-(4,7-dimethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylic acid Openeye Name: (11E)-11-[2-(4,7-dimethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylic acid CAS Name: (11E)-11-[2-(4,7-dimethoxy-1-benzimidazolyl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid IUPAC Name: (11E)-11-[2-(4,7-dimethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylic acid Traditional Name: (11E)-11-[2-(4,7-dimethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)N(C=N2)CC=C3C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)O

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)N(C=N2)C/C=C/3\C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)O

InChI

InChI=1S/C26H22N2O5/c1-31-22-9-10-23(32-2)25-24(22)27-15-28(25)12-11-19-18-6-4-3-5-17(18)14-33-21-8-7-16(26(29)30)13-20(19)21/h3-11,13,15H,12,14H2,1-2H3,(H,29,30)/b19-11+