N-[(3-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-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(=CC=C2)Cl)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O3S/c22-20-8-4-7-18(15-20)16-23-21(25)19-9-12-24(13-10-19)28(26,27)14-11-17-5-2-1-3-6-17/h1-8,11,14-15,19H,9-10,12-13,16H2,(H,23,25)/b14-11+