[2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-(4-chlorophenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C16H19ClN2O6S MolecularWeight: 402.84986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)C2CC(CN2S(=O)(=O)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1CC1NC(=O)COC(=O)[C@@H]2C[C@@H](CN2S(=O)(=O)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C16H19ClN2O6S/c17-10-1-5-13(6-2-10)26(23,24)19-8-12(20)7-14(19)16(22)25-9-15(21)18-11-3-4-11/h1-2,5-6,11-12,14,20H,3-4,7-9H2,(H,18,21)/t12-,14-/m0/s1