1-[(E)-2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-2-cyano-2-(p-tolylsulfonyl)vinyl]piperidine-4-carboxamide CAS Name: 1-[(E)-2-cyano-2-(4-methylphenyl)sulfonylethenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-2-cyano-2-(4-methylphenyl)sulfonylethenyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-2-cyano-2-tosyl-vinyl]isonipecotamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CN2CCC(CC2)C(=O)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/N2CCC(CC2)C(=O)N)/C#N

InChI

InChI=1S/C16H19N3O3S/c1-12-2-4-14(5-3-12)23(21,22)15(10-17)11-19-8-6-13(7-9-19)16(18)20/h2-5,11,13H,6-9H2,1H3,(H2,18,20)/b15-11+