N-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-benzylsulfonyl-N-[(4-ethoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-benzylsulfonyl-N-[(4-ethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-benzylsulfonyl-N-(4-ethoxybenzyl)isonipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

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