N-[(2,5-dimethoxyphenyl)methyl]-1-piperidin-1-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-piperidin-1-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-(1-piperidylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-(1-piperidinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-1-piperidinosulfonyl-isonipecotamide Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H31N3O5S/c1-27-18-6-7-19(28-2)17(14-18)15-21-20(24)16-8-12-23(13-9-16)29(25,26)22-10-4-3-5-11-22/h6-7,14,16H,3-5,8-13,15H2,1-2H3,(H,21,24)