(3S)-N-(furan-2-ylmethyl)-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(furan-2-ylmethyl)-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2-furylmethyl)-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2-furanylmethyl)-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(furan-2-ylmethyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2-furfuryl)-1-mesyl-nipecotamide Formula: C12H18N2O4S MolecularWeight: 286.34732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C(=O)NCC2=CC=CO2

Isomeric SMILES

CS(=O)(=O)N1CCC[C@@H](C1)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C12H18N2O4S/c1-19(16,17)14-6-2-4-10(9-14)12(15)13-8-11-5-3-7-18-11/h3,5,7,10H,2,4,6,8-9H2,1H3,(H,13,15)/t10-/m0/s1