N-(4,5-dimethoxy-2-methyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)OC)OC

InChI

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