[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenoxy)propanoate

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenoxy)propanoate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 3-(4-methoxyphenoxy)propanoate CAS Name: 3-(4-methoxyphenoxy)propanoic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenoxy)propanoate Traditional Name: 3-(4-methoxyphenoxy)propionic acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C19H20N2O7 MolecularWeight: 388.3713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCOC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCOC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H20N2O7/c1-13(19(23)20-14-4-3-5-15(12-14)21(24)25)28-18(22)10-11-27-17-8-6-16(26-2)7-9-17/h3-9,12-13H,10-11H2,1-2H3,(H,20,23)