N-tert-butyl-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-tert-butyl-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-tert-butyl-1-(m-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-tert-butyl-1-[(3-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-tert-butyl-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-tert-butyl-1-(3-methylbenzyl)sulfonyl-isonipecotamide Formula: C18H28N2O3S MolecularWeight: 352.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC(C)(C)C

InChI

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