N-(3,5-dimethoxyphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,5-dimethoxyphenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3,5-dimethoxyphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,5-dimethoxyphenyl)-1-tosyl-isonipecotamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-15-4-6-20(7-5-15)29(25,26)23-10-8-16(9-11-23)21(24)22-17-12-18(27-2)14-19(13-17)28-3/h4-7,12-14,16H,8-11H2,1-3H3,(H,22,24)