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

Systemtic Name: N-(4-cyanophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-cyanophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-cyanophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-cyanophenyl)-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-cyanophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-isonipecotamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C21H23N3O5S/c1-28-19-8-7-18(13-20(19)29-2)30(26,27)24-11-9-16(10-12-24)21(25)23-17-5-3-15(14-22)4-6-17/h3-8,13,16H,9-12H2,1-2H3,(H,23,25)