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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)N/C=C/3\C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3/c1-10-5-14-15(6-11(10)2)19(9-17-14)18-8-12-7-13(20(22)23)3-4-16(12)21/h3-9,18H,1-2H3/b12-8+