(phenylmethyl) 4-(2-ethylsulfanylphenyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(2-ethylsulfanylphenyl)piperidine-1-carboxylate Openeye Name: benzyl 4-(2-ethylsulfanylphenyl)piperidine-1-carboxylate CAS Name: 4-[2-(ethylthio)phenyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-ethylsulfanylphenyl)piperidine-1-carboxylate Traditional Name: 4-[2-(ethylthio)phenyl]piperidine-1-carboxylic acid benzyl ester Formula: C21H25NO2S MolecularWeight: 355.4937

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=CC=C1C2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO2S/c1-2-25-20-11-7-6-10-19(20)18-12-14-22(15-13-18)21(23)24-16-17-8-4-3-5-9-17/h3-11,18H,2,12-16H2,1H3