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

Systemtic Name: [(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Openeye Name: [(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 5-isopropyl-3-methyl-isoxazole-4-carboxylate CAS Name: 3-methyl-5-propan-2-yl-4-isoxazolecarboxylic acid [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Traditional Name: 5-isopropyl-3-methyl-isoxazole-4-carboxylic acid [(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)O[C@H](C)C(=O)NC2=CC=CC=C2[N+](=O)[O-])C(C)C

InChI

InChI=1S/C17H19N3O6/c1-9(2)15-14(10(3)19-26-15)17(22)25-11(4)16(21)18-12-7-5-6-8-13(12)20(23)24/h5-9,11H,1-4H3,(H,18,21)/t11-/m1/s1