3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(2-methylphenyl)ethenyl]sulfonyl-piperidine-1-carboxamide

Systemtic Name: 3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(2-methylphenyl)ethenyl]sulfonyl-piperidine-1-carboxamide Openeye Name: 3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(o-tolyl)vinyl]sulfonyl-piperidine-1-carboxamide CAS Name: 3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(2-methylphenyl)ethenyl]sulfonyl-1-piperidinecarboxamide IUPAC Name: 3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(2-methylphenyl)ethenyl]sulfonylpiperidine-1-carboxamide Traditional Name: 3-[3-(4-butoxyphenyl)propyl]-N-[(E)-2-(o-tolyl)vinyl]sulfonyl-piperidine-1-carboxamide Formula: C28H38N2O4S MolecularWeight: 498.67732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CCCC2CCCN(C2)C(=O)NS(=O)(=O)C=CC3=CC=CC=C3C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CCCC2CCCN(C2)C(=O)NS(=O)(=O)/C=C/C3=CC=CC=C3C

InChI

InChI=1S/C28H38N2O4S/c1-3-4-20-34-27-16-14-24(15-17-27)10-7-11-25-12-8-19-30(22-25)28(31)29-35(32,33)21-18-26-13-6-5-9-23(26)2/h5-6,9,13-18,21,25H,3-4,7-8,10-12,19-20,22H2,1-2H3,(H,29,31)/b21-18+