(6E)-6-[[(1,2-dimethylbenzimidazol-5-yl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[(1,2-dimethylbenzimidazol-5-yl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[(1,2-dimethylbenzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[(1,2-dimethyl-5-benzimidazolyl)amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[(1,2-dimethylbenzimidazol-5-yl)amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[(1,2-dimethylbenzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C)C=CC(=C2)NC=C3C=CC=C(C3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(N1C)C=CC(=C2)N/C=C/3\C=CC=C(C3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3/c1-10-18-13-8-12(6-7-14(13)19(10)2)17-9-11-4-3-5-15(16(11)21)20(22)23/h3-9,17H,1-2H3/b11-9+