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

Systemtic Name: (6E)-6-[[[2-methyl-1-(phenylmethyl)benzimidazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[(1-benzyl-2-methyl-benzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[[2-methyl-1-(phenylmethyl)-5-benzimidazolyl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[(1-benzyl-2-methylbenzimidazol-5-yl)amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[(1-benzyl-2-methyl-benzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)N/C=C/4\C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O3/c1-15-24-19-12-18(23-13-17-8-5-9-21(22(17)27)26(28)29)10-11-20(19)25(15)14-16-6-3-2-4-7-16/h2-13,23H,14H2,1H3/b17-13+