ethyl 3-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(3,4-dihydroxy-5-nitro-phenyl)-3-oxo-propanoate CAS Name: 3-(3,4-dihydroxy-5-nitrophenyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dihydroxy-5-nitrophenyl)-3-oxopropanoate Traditional Name: 3-(3,4-dihydroxy-5-nitro-phenyl)-3-keto-propionic acid ethyl ester Formula: C11H11NO7 MolecularWeight: 269.20754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO7/c1-2-19-10(15)5-8(13)6-3-7(12(17)18)11(16)9(14)4-6/h3-4,14,16H,2,5H2,1H3