N-butan-2-yl-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-butan-2-yl-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: 1-(p-tolylmethylsulfonyl)-N-sec-butyl-piperidine-4-carboxamide CAS Name: N-butan-2-yl-1-[(4-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-butan-2-yl-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(4-methylbenzyl)sulfonyl-N-sec-butyl-isonipecotamide Formula: C18H28N2O3S MolecularWeight: 352.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C

Isomeric SMILES

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C

InChI

InChI=1S/C18H28N2O3S/c1-4-15(3)19-18(21)17-9-11-20(12-10-17)24(22,23)13-16-7-5-14(2)6-8-16/h5-8,15,17H,4,9-13H2,1-3H3,(H,19,21)