ethyl 4-(2-phenoxyethyl)-1-(thiolan-3-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-(2-phenoxyethyl)-1-(thiolan-3-yl)piperidine-4-carboxylate Openeye Name: ethyl 4-(2-phenoxyethyl)-1-tetrahydrothiophen-3-yl-piperidine-4-carboxylate CAS Name: 4-(2-phenoxyethyl)-1-(3-thiolanyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-phenoxyethyl)-1-(thiolan-3-yl)piperidine-4-carboxylate Traditional Name: 4-(2-phenoxyethyl)-1-tetrahydrothiophen-3-yl-isonipecotic acid ethyl ester Formula: C20H29NO3S MolecularWeight: 363.51416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C2CCSC2)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C2CCSC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C20H29NO3S/c1-2-23-19(22)20(11-14-24-18-6-4-3-5-7-18)9-12-21(13-10-20)17-8-15-25-16-17/h3-7,17H,2,8-16H2,1H3