N-[(4-ethoxyphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-ethoxybenzyl)-1-(4-methylpiperidino)sulfonyl-nipecotamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C21H33N3O4S/c1-3-28-20-8-6-18(7-9-20)15-22-21(25)19-5-4-12-24(16-19)29(26,27)23-13-10-17(2)11-14-23/h6-9,17,19H,3-5,10-16H2,1-2H3,(H,22,25)