(3S)-N-(2,6-diethylphenyl)-1-ethylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2,6-diethylphenyl)-1-ethylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2,6-diethylphenyl)-1-ethylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2,6-diethylphenyl)-1-ethylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2,6-diethylphenyl)-1-ethylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2,6-diethylphenyl)-1-esyl-nipecotamide Formula: C18H28N2O3S MolecularWeight: 352.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCCN(C2)S(=O)(=O)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)CC

InChI

InChI=1S/C18H28N2O3S/c1-4-14-9-7-10-15(5-2)17(14)19-18(21)16-11-8-12-20(13-16)24(22,23)6-3/h7,9-10,16H,4-6,8,11-13H2,1-3H3,(H,19,21)/t16-/m0/s1