6-[[[4-(1H-benzimidazol-2-yl)phenyl]amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(1H-benzimidazol-2-yl)phenyl]amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(1H-benzimidazol-2-yl)anilino]methylene]-4-benzyl-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(1H-benzimidazol-2-yl)anilino]methylidene]-2-nitro-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(1H-benzimidazol-2-yl)anilino]methylidene]-4-benzyl-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(1H-benzimidazol-2-yl)anilino]methylene]-4-benzyl-2-nitro-cyclohexa-2,4-dien-1-one Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CNC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4)C(=O)C(=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CNC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4)C(=O)C(=C2)[N+](=O)[O-]

InChI

InChI=1S/C27H20N4O3/c32-26-21(15-19(16-25(26)31(33)34)14-18-6-2-1-3-7-18)17-28-22-12-10-20(11-13-22)27-29-23-8-4-5-9-24(23)30-27/h1-13,15-17,28H,14H2,(H,29,30)