N-(3,4-dimethylphenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3S/c1-17-8-9-21(16-18(17)2)23-22(25)20-10-13-24(14-11-20)28(26,27)15-12-19-6-4-3-5-7-19/h3-9,12,15-16,20H,10-11,13-14H2,1-2H3,(H,23,25)/b15-12+