ethyl 4-oxidanyl-4-[2-(2-sulfanylethyl)phenyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-oxidanyl-4-[2-(2-sulfanylethyl)phenyl]piperidine-1-carboxylate Openeye Name: ethyl 4-hydroxy-4-[2-(2-sulfanylethyl)phenyl]piperidine-1-carboxylate CAS Name: 4-hydroxy-4-[2-(2-mercaptoethyl)phenyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-4-[2-(2-sulfanylethyl)phenyl]piperidine-1-carboxylate Traditional Name: 4-hydroxy-4-[2-(2-mercaptoethyl)phenyl]piperidine-1-carboxylic acid ethyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)(C2=CC=CC=C2CCS)O

Isomeric SMILES

CCOC(=O)N1CCC(CC1)(C2=CC=CC=C2CCS)O

InChI

InChI=1S/C16H23NO3S/c1-2-20-15(18)17-10-8-16(19,9-11-17)14-6-4-3-5-13(14)7-12-21/h3-6,19,21H,2,7-12H2,1H3