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

Systemtic Name: (11E)-11-[2-(6-methoxycarbonylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: (11E)-11-[2-(6-methoxycarbonylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[2-(6-methoxycarbonyl-1-benzimidazolyl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate IUPAC Name: (11E)-11-[2-(6-methoxycarbonylbenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[2-(6-carbomethoxybenzimidazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate Formula: C26H19N2O5- MolecularWeight: 439.43946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=CN2CC=C3C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=CN2C/C=C/3\C4=CC=CC=C4COC5=C3C=C(C=C5)C(=O)[O-]

InChI

InChI=1S/C26H20N2O5/c1-32-26(31)17-6-8-22-23(13-17)28(15-27-22)11-10-20-19-5-3-2-4-18(19)14-33-24-9-7-16(25(29)30)12-21(20)24/h2-10,12-13,15H,11,14H2,1H3,(H,29,30)/p-1/b20-10+