4-(4-chlorophenyl)sulfanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-(4-chlorophenyl)sulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 4-[(4-chlorophenyl)thio]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(4-chlorophenyl)sulfanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-[(4-chlorophenyl)thio]proline Formula: C16H20ClNO4S MolecularWeight: 357.8523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClNO4S/c1-16(2,3)22-15(21)18-9-12(8-13(18)14(19)20)23-11-6-4-10(17)5-7-11/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)