6-[[[3-(1H-benzimidazol-2-yl)-4-chloranyl-phenyl]amino]methylidene]-2-methyl-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[3-(1H-benzimidazol-2-yl)-4-chloranyl-phenyl]amino]methylidene]-2-methyl-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[3-(1H-benzimidazol-2-yl)-4-chloro-anilino]methylene]-2-methyl-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(1H-benzimidazol-2-yl)-4-chloroanilino]methylidene]-2-methyl-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[3-(1H-benzimidazol-2-yl)-4-chloroanilino]methylidene]-2-methyl-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[3-(1H-benzimidazol-2-yl)-4-chloro-anilino]methylene]-2-methyl-4-nitro-cyclohexa-2,4-dien-1-one Formula: C21H15ClN4O3 MolecularWeight: 406.8218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=CNC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4N3)C1=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=CNC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4N3)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN4O3/c1-12-8-15(26(28)29)9-13(20(12)27)11-23-14-6-7-17(22)16(10-14)21-24-18-4-2-3-5-19(18)25-21/h2-11,23H,1H3,(H,24,25)