ethyl 4-(3-phenylpropyl)-1-(thiolan-3-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-(3-phenylpropyl)-1-(thiolan-3-yl)piperidine-4-carboxylate Openeye Name: ethyl 4-(3-phenylpropyl)-1-tetrahydrothiophen-3-yl-piperidine-4-carboxylate CAS Name: 4-(3-phenylpropyl)-1-(3-thiolanyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenylpropyl)-1-(thiolan-3-yl)piperidine-4-carboxylate Traditional Name: 4-(3-phenylpropyl)-1-tetrahydrothiophen-3-yl-isonipecotic acid ethyl ester Formula: C21H31NO2S MolecularWeight: 361.54134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C2CCSC2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C2CCSC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H31NO2S/c1-2-24-20(23)21(11-6-9-18-7-4-3-5-8-18)12-14-22(15-13-21)19-10-16-25-17-19/h3-5,7-8,19H,2,6,9-17H2,1H3