N-[(3,4-diethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-benzylsulfonyl-N-[(3,4-diethoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-1-(phenylmethyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-benzylsulfonyl-N-[(3,4-diethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-benzylsulfonyl-N-(3,4-diethoxybenzyl)isonipecotamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O5S/c1-3-30-22-11-10-20(16-23(22)31-4-2)17-25-24(27)21-12-14-26(15-13-21)32(28,29)18-19-8-6-5-7-9-19/h5-11,16,21H,3-4,12-15,17-18H2,1-2H3,(H,25,27)