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

Systemtic Name: (6E)-6-[[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]amino]methylidene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-2-ethoxy-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-2-ethoxy-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=CNC2=C(C=CC(=C2)C3=NC4=CC=CC=C4N3)C)C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C/C(=C\NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4N3)C)/C1=O)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O4/c1-3-31-21-12-17(27(29)30)10-16(22(21)28)13-24-20-11-15(9-8-14(20)2)23-25-18-6-4-5-7-19(18)26-23/h4-13,24H,3H2,1-2H3,(H,25,26)/b16-13+