N-[(2-ethoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(2-ethoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(2-ethoxybenzyl)-1-tosyl-nipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H28N2O4S/c1-3-28-21-9-5-4-7-18(21)15-23-22(25)19-8-6-14-24(16-19)29(26,27)20-12-10-17(2)11-13-20/h4-5,7,9-13,19H,3,6,8,14-16H2,1-2H3,(H,23,25)