[(2R)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [(1R)-2-(isopropylamino)-1-methyl-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [(1R)-2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H22N2O7 MolecularWeight: 354.35508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OC(C)C(=O)NC(C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)O[C@H](C)C(=O)NC(C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C16H22N2O7/c1-6-24-14-7-11(12(18(21)22)8-13(14)23-5)16(20)25-10(4)15(19)17-9(2)3/h7-10H,6H2,1-5H3,(H,17,19)/t10-/m1/s1