ethyl 1-(3-phenylsulfanylpropanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(3-phenylsulfanylpropanoyl)piperidine-3-carboxylate Openeye Name: ethyl 1-(3-phenylsulfanylpropanoyl)piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-(phenylthio)propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-phenylsulfanylpropanoyl)piperidine-3-carboxylate Traditional Name: 1-[3-(phenylthio)propanoyl]nipecotic acid ethyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C17H23NO3S/c1-2-21-17(20)14-7-6-11-18(13-14)16(19)10-12-22-15-8-4-3-5-9-15/h3-5,8-9,14H,2,6-7,10-13H2,1H3