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

Systemtic Name: N-heptan-2-yl-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-(1-methylhexyl)piperidine-4-carboxamide CAS Name: N-heptan-2-yl-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-heptan-2-yl-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-(1-methylhexyl)isonipecotamide Formula: C20H32N2O4S MolecularWeight: 396.54408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N2O4S/c1-4-5-6-7-16(2)21-20(23)17-12-14-22(15-13-17)27(24,25)19-10-8-18(26-3)9-11-19/h8-11,16-17H,4-7,12-15H2,1-3H3,(H,21,23)