1-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenyl-3-sulfanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenyl-3-sulfanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-2-phenyl-3-thioxo-pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-phenyl-3-sulfanylidene-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenyl-3-sulfanylidenepyrrolidine-2-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-2-phenyl-3-thioxo-proline Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=S)C1(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(=S)C1(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H19NO4S/c1-15(2,3)21-14(20)17-10-9-12(22)16(17,13(18)19)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,18,19)