1-(4-methylphenyl)sulfonyl-N-nonyl-piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-nonyl-piperidine-4-carboxamide Openeye Name: N-nonyl-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-nonyl-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-nonylpiperidine-4-carboxamide Traditional Name: N-nonyl-1-tosyl-isonipecotamide Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H36N2O3S/c1-3-4-5-6-7-8-9-16-23-22(25)20-14-17-24(18-15-20)28(26,27)21-12-10-19(2)11-13-21/h10-13,20H,3-9,14-18H2,1-2H3,(H,23,25)