[(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-oxidanylbenzoate

Systemtic Name: [(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-oxidanylbenzoate Openeye Name: [(1R)-1-methyl-2-(4-nitroanilino)-2-oxo-ethyl] 3-hydroxybenzoate CAS Name: 3-hydroxybenzoic acid [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] 3-hydroxybenzoate Traditional Name: 3-hydroxybenzoic acid [(1R)-2-keto-1-methyl-2-(4-nitroanilino)ethyl] ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O6/c1-10(24-16(21)11-3-2-4-14(19)9-11)15(20)17-12-5-7-13(8-6-12)18(22)23/h2-10,19H,1H3,(H,17,20)/t10-/m1/s1