tert-butyl 4-[2-(phenylsulfinyl)ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(phenylsulfinyl)ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(benzenesulfinyl)ethyl]piperidine-1-carboxylate CAS Name: 4-[2-(benzenesulfinyl)ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(benzenesulfinyl)ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-(benzenesulfinyl)ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCS(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCS(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H27NO3S/c1-18(2,3)22-17(20)19-12-9-15(10-13-19)11-14-23(21)16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3