N-(2-methoxy-5-methyl-phenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C22H26N2O4S MolecularWeight: 414.51784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c1-17-8-9-21(28-2)20(16-17)23-22(25)19-10-13-24(14-11-19)29(26,27)15-12-18-6-4-3-5-7-18/h3-9,12,15-16,19H,10-11,13-14H2,1-2H3,(H,23,25)/b15-12+