(6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-methoxy-2-nitro-6-[[(2-phenyl-3H-benzimidazol-5-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNC2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

COC1=C/C(=C\NC2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4)/C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4/c1-29-16-9-14(20(26)19(11-16)25(27)28)12-22-15-7-8-17-18(10-15)24-21(23-17)13-5-3-2-4-6-13/h2-12,22H,1H3,(H,23,24)/b14-12+