[4-(2,2-dicyanoethenyl)phenyl] 1-(4-acetamidophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [4-(2,2-dicyanoethenyl)phenyl] 1-(4-acetamidophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [4-(2,2-dicyanovinyl)phenyl] 1-(4-acetamidophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-acetamidophenyl)sulfonyl-4-piperidinecarboxylic acid [4-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)phenyl] 1-(4-acetamidophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-acetamidophenyl)sulfonylisonipecotic acid [4-(2,2-dicyanovinyl)phenyl] ester Formula: C24H22N4O5S MolecularWeight: 478.52028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C=C(C#N)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C=C(C#N)C#N

InChI

InChI=1S/C24H22N4O5S/c1-17(29)27-21-4-8-23(9-5-21)34(31,32)28-12-10-20(11-13-28)24(30)33-22-6-2-18(3-7-22)14-19(15-25)16-26/h2-9,14,20H,10-13H2,1H3,(H,27,29)