N-(2,4-dimethylphenyl)-1-(4-ethoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-1-(4-ethoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-1-(4-ethoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(2,4-dimethylphenyl)-1-(4-ethoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-1-(4-ethoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-1-p-phenetylsulfonyl-nipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C22H28N2O4S/c1-4-28-19-8-10-20(11-9-19)29(26,27)24-13-5-6-18(15-24)22(25)23-21-12-7-16(2)14-17(21)3/h7-12,14,18H,4-6,13,15H2,1-3H3,(H,23,25)