[4-(2,2-dicyanoethenyl)phenyl] 1-(2-nitrophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: [4-(2,2-dicyanoethenyl)phenyl] 1-(2-nitrophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: [4-(2,2-dicyanovinyl)phenyl] 1-(2-nitrophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(2-nitrophenyl)sulfonyl-3-piperidinecarboxylic acid [4-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)phenyl] 1-(2-nitrophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(2-nitrophenyl)sulfonylnipecotic acid [4-(2,2-dicyanovinyl)phenyl] ester Formula: C22H18N4O6S MolecularWeight: 466.46652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC3=CC=C(C=C3)C=C(C#N)C#N

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC3=CC=C(C=C3)C=C(C#N)C#N

InChI

InChI=1S/C22H18N4O6S/c23-13-17(14-24)12-16-7-9-19(10-8-16)32-22(27)18-4-3-11-25(15-18)33(30,31)21-6-2-1-5-20(21)26(28)29/h1-2,5-10,12,18H,3-4,11,15H2