N-[(4-ethoxyphenyl)methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-ethoxybenzyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-2-27-18-7-5-16(6-8-18)14-22-20(24)17-9-12-23(13-10-17)28(25,26)19-4-3-11-21-15-19/h3-8,11,15,17H,2,9-10,12-14H2,1H3,(H,22,24)