methyl 4-[[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate Openeye Name: methyl 4-[[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl]amino]benzoate CAS Name: 4-[[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]amino]benzoate Traditional Name: 4-[[(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl]amino]benzoic acid methyl ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H17N3O5/c1-11(18-13-9-7-12(8-10-13)17(22)25-2)16(21)19-14-5-3-4-6-15(14)20(23)24/h3-11,18H,1-2H3,(H,19,21)/t11-/m1/s1