ethyl 3-(5-methoxy-2-nitro-phenyl)-2-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(5-methoxy-2-nitro-phenyl)-2-oxidanylidene-propanoate Openeye Name: ethyl 3-(5-methoxy-2-nitro-phenyl)-2-oxo-propanoate CAS Name: 3-(5-methoxy-2-nitrophenyl)-2-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(5-methoxy-2-nitrophenyl)-2-oxopropanoate Traditional Name: 2-keto-3-(5-methoxy-2-nitro-phenyl)propionic acid ethyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC1=C(C=CC(=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)CC1=C(C=CC(=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO6/c1-3-19-12(15)11(14)7-8-6-9(18-2)4-5-10(8)13(16)17/h4-6H,3,7H2,1-2H3