(phenylmethyl) 4-(phenylmethylsulfanyl)carbonylpiperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(phenylmethylsulfanyl)carbonylpiperidine-1-carboxylate Openeye Name: benzyl 4-benzylsulfanylcarbonylpiperidine-1-carboxylate CAS Name: 4-[oxo-(phenylmethylthio)methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-benzylsulfanylcarbonylpiperidine-1-carboxylate Traditional Name: 4-(benzylthio)carbonylpiperidine-1-carboxylic acid benzyl ester Formula: C21H23NO3S MolecularWeight: 369.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)SCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)SCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO3S/c23-20(26-16-18-9-5-2-6-10-18)19-11-13-22(14-12-19)21(24)25-15-17-7-3-1-4-8-17/h1-10,19H,11-16H2