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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-15-6-9-18(10-7-15)29(25,26)23-12-4-5-16(14-23)21(24)22-17-8-11-19(27-2)20(13-17)28-3/h6-11,13,16H,4-5,12,14H2,1-3H3,(H,22,24)