[6-ethyl-3-(1-methylbenzimidazol-2-yl)-2-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] 4-nitrobenzoate

Systemtic Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-2-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] 4-nitrobenzoate Openeye Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-2-(4-nitrophenyl)-4-oxo-chromen-7-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [6-ethyl-3-(1-methyl-2-benzimidazolyl)-2-(4-nitrophenyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-2-(4-nitrophenyl)-4-oxochromen-7-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [6-ethyl-4-keto-3-(1-methylbenzimidazol-2-yl)-2-(4-nitrophenyl)chromen-7-yl] ester Formula: C32H22N4O8 MolecularWeight: 590.53908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C4=NC5=CC=CC=C5N4C)OC(=O)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C4=NC5=CC=CC=C5N4C)OC(=O)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C32H22N4O8/c1-3-18-16-23-27(17-26(18)44-32(38)20-10-14-22(15-11-20)36(41)42)43-30(19-8-12-21(13-9-19)35(39)40)28(29(23)37)31-33-24-6-4-5-7-25(24)34(31)2/h4-17H,3H2,1-2H3