[(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3,4,5-trimethoxybenzoate Openeye Name: [(1R)-1-methyl-2-(4-nitroanilino)-2-oxo-ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [(1R)-2-keto-1-methyl-2-(4-nitroanilino)ethyl] ester Formula: C19H20N2O8 MolecularWeight: 404.3707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O8/c1-11(18(22)20-13-5-7-14(8-6-13)21(24)25)29-19(23)12-9-15(26-2)17(28-4)16(10-12)27-3/h5-11H,1-4H3,(H,20,22)/t11-/m1/s1