methyl 2-methyl-3-(4-nitrophenyl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 2-methyl-3-(4-nitrophenyl)-3-oxidanylidene-propanoate Openeye Name: methyl 2-methyl-3-(4-nitrophenyl)-3-oxo-propanoate CAS Name: 2-methyl-3-(4-nitrophenyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-nitrophenyl)-3-oxopropanoate Traditional Name: 3-keto-2-methyl-3-(4-nitrophenyl)propionic acid methyl ester Formula: C11H11NO5 MolecularWeight: 237.20874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO5/c1-7(11(14)17-2)10(13)8-3-5-9(6-4-8)12(15)16/h3-7H,1-2H3