N-[(4-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)Cl)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)Cl)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23ClN2O3S/c22-20-8-6-18(7-9-20)16-23-21(25)19-10-13-24(14-11-19)28(26,27)15-12-17-4-2-1-3-5-17/h1-9,12,15,19H,10-11,13-14,16H2,(H,23,25)/b15-12+