N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(4-nitrophenyl)diazenyl]-3-oxidanylidene-butanamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(4-nitrophenyl)diazenyl]-3-oxidanylidene-butanamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(4-nitrophenyl)azo-3-oxo-butanamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-nitrophenyl)azo-3-oxobutanamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(4-nitrophenyl)diazenyl]-3-oxobutanamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-keto-2-(4-nitrophenyl)azo-butyramide Formula: C18H17ClN4O6 MolecularWeight: 420.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O6/c1-10(24)17(22-21-11-4-6-12(7-5-11)23(26)27)18(25)20-14-9-15(28-2)13(19)8-16(14)29-3/h4-9,17H,1-3H3,(H,20,25)