methyl (11E)-11-[2-(4-methylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl (11E)-11-[2-(4-methylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl (11E)-11-[2-(4-methylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[2-(4-methyl-1-benzimidazolyl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl (11E)-11-[2-(4-methylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[2-(4-methylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C=N2)CC=C3C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C2C(=CC=C1)N(C=N2)C/C=C/3\C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)OC

InChI

InChI=1S/C26H22N2O3/c1-17-6-5-9-23-25(17)27-16-28(23)13-12-21-20-8-4-3-7-19(20)15-31-24-11-10-18(14-22(21)24)26(29)30-2/h3-12,14,16H,13,15H2,1-2H3/b21-12+