N-[[4-(ethoxymethyl)phenyl]methyl]-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: N-[[4-(ethoxymethyl)phenyl]methyl]-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[4-(ethoxymethyl)phenyl]methyl]-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-2-carboxamide Traditional Name: 1-besyl-N-[4-(ethoxymethyl)benzyl]pipecolinamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-2-28-17-19-13-11-18(12-14-19)16-23-22(25)21-10-6-7-15-24(21)29(26,27)20-8-4-3-5-9-20/h3-5,8-9,11-14,21H,2,6-7,10,15-17H2,1H3,(H,23,25)