methyl 4-[4-(3-methoxy-4-nitro-phenyl)phenyl]-2,2-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-(3-methoxy-4-nitro-phenyl)phenyl]-2,2-dimethyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-(3-methoxy-4-nitro-phenyl)phenyl]-2,2-dimethyl-4-oxo-butanoate CAS Name: 4-[4-(3-methoxy-4-nitrophenyl)phenyl]-2,2-dimethyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-(3-methoxy-4-nitrophenyl)phenyl]-2,2-dimethyl-4-oxobutanoate Traditional Name: 4-keto-4-[4-(3-methoxy-4-nitro-phenyl)phenyl]-2,2-dimethyl-butyric acid methyl ester Formula: C20H21NO6 MolecularWeight: 371.38384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)[N+](=O)[O-])OC)C(=O)OC

Isomeric SMILES

CC(C)(CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)[N+](=O)[O-])OC)C(=O)OC

InChI

InChI=1S/C20H21NO6/c1-20(2,19(23)27-4)12-17(22)14-7-5-13(6-8-14)15-9-10-16(21(24)25)18(11-15)26-3/h5-11H,12H2,1-4H3