tert-butyl 4-(3-phenylpropylsulfanylcarbonyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-phenylpropylsulfanylcarbonyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(3-phenylpropylsulfanylcarbonyl)piperidine-1-carboxylate CAS Name: 4-[oxo-(3-phenylpropylthio)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-phenylpropylsulfanylcarbonyl)piperidine-1-carboxylate Traditional Name: 4-(3-phenylpropylthio)carbonylpiperidine-1-carboxylic acid tert-butyl ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)SCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)SCCCC2=CC=CC=C2

InChI

InChI=1S/C20H29NO3S/c1-20(2,3)24-19(23)21-13-11-17(12-14-21)18(22)25-15-7-10-16-8-5-4-6-9-16/h4-6,8-9,17H,7,10-15H2,1-3H3