1-(4-tert-butylphenyl)sulfonyl-N-heptan-2-yl-piperidine-4-carboxamide

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-N-heptan-2-yl-piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-(1-methylhexyl)piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-heptan-2-yl-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-heptan-2-ylpiperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-(1-methylhexyl)isonipecotamide Formula: C23H38N2O3S MolecularWeight: 422.62442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H38N2O3S/c1-6-7-8-9-18(2)24-22(26)19-14-16-25(17-15-19)29(27,28)21-12-10-20(11-13-21)23(3,4)5/h10-13,18-19H,6-9,14-17H2,1-5H3,(H,24,26)