ethyl 4-[(2R)-1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2R)-1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(1R)-2-(3-chloroanilino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[(2R)-1-(3-chloroanilino)-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-1-(3-chloroanilino)-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[(1R)-2-(3-chloroanilino)-2-keto-1-methyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22ClN3O3 MolecularWeight: 339.81718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H](C)C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H22ClN3O3/c1-3-23-16(22)20-9-7-19(8-10-20)12(2)15(21)18-14-6-4-5-13(17)11-14/h4-6,11-12H,3,7-10H2,1-2H3,(H,18,21)/t12-/m1/s1