N-(4-acetamidophenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-acetamidophenyl)-1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-isonipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-15-14-20(8-9-21(15)30-3)31(28,29)25-12-10-17(11-13-25)22(27)24-19-6-4-18(5-7-19)23-16(2)26/h4-9,14,17H,10-13H2,1-3H3,(H,23,26)(H,24,27)