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

Systemtic Name: 6-[[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]amino]methylidene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-4-methyl-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-4-methyl-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])C

InChI

InChI=1S/C22H18N4O3/c1-13-9-16(21(27)20(10-13)26(28)29)12-23-19-11-15(8-7-14(19)2)22-24-17-5-3-4-6-18(17)25-22/h3-12,23H,1-2H3,(H,24,25)