tert-butyl 3-(phenylsulfanylmethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-(phenylsulfanylmethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-(phenylsulfanylmethyl)pyrrolidine-1-carboxylate CAS Name: 3-[(phenylthio)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(phenylsulfanylmethyl)pyrrolidine-1-carboxylate Traditional Name: 3-[(phenylthio)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)CSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)CSC2=CC=CC=C2

InChI

InChI=1S/C16H23NO2S/c1-16(2,3)19-15(18)17-10-9-13(11-17)12-20-14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3