tert-butyl 2-(1-oxidanyl-2-phenylsulfanyl-ethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(1-oxidanyl-2-phenylsulfanyl-ethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(1-hydroxy-2-phenylsulfanyl-ethyl)pyrrolidine-1-carboxylate CAS Name: 2-[1-hydroxy-2-(phenylthio)ethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(1-hydroxy-2-phenylsulfanylethyl)pyrrolidine-1-carboxylate Traditional Name: 2-[1-hydroxy-2-(phenylthio)ethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(CSC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(CSC2=CC=CC=C2)O

InChI

InChI=1S/C17H25NO3S/c1-17(2,3)21-16(20)18-11-7-10-14(18)15(19)12-22-13-8-5-4-6-9-13/h4-6,8-9,14-15,19H,7,10-12H2,1-3H3