(3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-isopentyl-piperidine-3-carboxamide CAS Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(3-methylbutyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-isoamyl-nipecotamide Formula: C19H30N2O5S MolecularWeight: 398.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC(C)CCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C19H30N2O5S/c1-14(2)9-10-20-19(22)15-6-5-11-21(13-15)27(23,24)18-12-16(25-3)7-8-17(18)26-4/h7-8,12,14-15H,5-6,9-11,13H2,1-4H3,(H,20,22)/t15-/m0/s1