methyl 5-[(4-nitrophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(4-nitrophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(4-nitroanilino)-5-oxo-pentanoate CAS Name: 5-(4-nitroanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(4-nitroanilino)-5-oxopentanoate Traditional Name: 5-keto-5-(4-nitroanilino)valeric acid methyl ester Formula: C12H14N2O5 MolecularWeight: 266.24996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5/c1-19-12(16)4-2-3-11(15)13-9-5-7-10(8-6-9)14(17)18/h5-8H,2-4H2,1H3,(H,13,15)