N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-isonipecotamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O6S/c1-15-13-18(6-8-20(15)29-3)31(26,27)24-11-9-16(10-12-24)22(25)23-19-14-17(28-2)5-7-21(19)30-4/h5-8,13-14,16H,9-12H2,1-4H3,(H,23,25)