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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C22H28N2O4S/c1-4-28-19-8-10-20(11-9-19)29(26,27)24-14-12-18(13-15-24)22(25)23-21-7-5-6-16(2)17(21)3/h5-11,18H,4,12-15H2,1-3H3,(H,23,25)