N-(5-methylhexan-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-methylhexan-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,4-dimethylpentyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-methylhexan-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-methylhexan-2-yl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,4-dimethylpentyl)-1-mesitylsulfonyl-isonipecotamide Formula: C22H36N2O3S MolecularWeight: 408.59784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC(C)C)C

InChI

InChI=1S/C22H36N2O3S/c1-15(2)7-8-19(6)23-22(25)20-9-11-24(12-10-20)28(26,27)21-17(4)13-16(3)14-18(21)5/h13-15,19-20H,7-12H2,1-6H3,(H,23,25)