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

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-N-heptan-2-yl-piperidine-4-carboxamide Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-N-(1-methylhexyl)piperidine-4-carboxamide CAS Name: 1-(4-ethoxyphenyl)sulfonyl-N-heptan-2-yl-4-piperidinecarboxamide IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-N-heptan-2-ylpiperidine-4-carboxamide Traditional Name: N-(1-methylhexyl)-1-p-phenetylsulfonyl-isonipecotamide Formula: C21H34N2O4S MolecularWeight: 410.57066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O4S/c1-4-6-7-8-17(3)22-21(24)18-13-15-23(16-14-18)28(25,26)20-11-9-19(10-12-20)27-5-2/h9-12,17-18H,4-8,13-16H2,1-3H3,(H,22,24)