N-(3-acetamido-2-methyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-acetamido-2-methyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-acetamido-2-methyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(3-acetamido-2-methylphenyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(3-acetamido-2-methylphenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(3-acetamido-2-methyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

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