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

Systemtic Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methylpropyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-isobutyl-piperidine-3-carboxamide CAS Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methylpropyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-isobutyl-nipecotamide Formula: C18H28N2O5S MolecularWeight: 384.49032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-13(2)11-19-18(21)14-6-5-9-20(12-14)26(22,23)17-10-15(24-3)7-8-16(17)25-4/h7-8,10,13-14H,5-6,9,11-12H2,1-4H3,(H,19,21)/t14-/m0/s1