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

Systemtic Name: 4-methoxy-6-[[(2-methyl-3H-benzimidazol-5-yl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-methoxy-6-[[(2-methyl-3H-benzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-methoxy-6-[[(2-methyl-3H-benzimidazol-5-yl)amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-methoxy-6-[[(2-methyl-3H-benzimidazol-5-yl)amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-methoxy-6-[[(2-methyl-3H-benzimidazol-5-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)C=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])OC

Isomeric SMILES

CC1=NC2=C(N1)C=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C16H14N4O4/c1-9-18-13-4-3-11(6-14(13)19-9)17-8-10-5-12(24-2)7-15(16(10)21)20(22)23/h3-8,17H,1-2H3,(H,18,19)