[4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] ester IUPAC Name: [4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[[2-(1H-benzimidazol-2-yl)phenyl]iminomethyl]phenyl] ester Formula: C27H18N4O4 MolecularWeight: 462.45622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)N=CC4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)N=CC4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H18N4O4/c32-27(19-6-5-7-20(16-19)31(33)34)35-21-14-12-18(13-15-21)17-28-23-9-2-1-8-22(23)26-29-24-10-3-4-11-25(24)30-26/h1-17H,(H,29,30)