[4-[2-cyano-2-(phenylsulfonyl)ethenyl]-2-ethoxy-phenyl] cyclohexanecarboxylate

Systemtic Name: [4-[2-cyano-2-(phenylsulfonyl)ethenyl]-2-ethoxy-phenyl] cyclohexanecarboxylate Openeye Name: [4-[2-(benzenesulfonyl)-2-cyano-vinyl]-2-ethoxy-phenyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [4-[2-(benzenesulfonyl)-2-cyanoethenyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[2-(benzenesulfonyl)-2-cyanoethenyl]-2-ethoxyphenyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-(2-besyl-2-cyano-vinyl)-2-ethoxy-phenyl] ester Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3CCCCC3

InChI

InChI=1S/C24H25NO5S/c1-2-29-23-16-18(13-14-22(23)30-24(26)19-9-5-3-6-10-19)15-21(17-25)31(27,28)20-11-7-4-8-12-20/h4,7-8,11-16,19H,2-3,5-6,9-10H2,1H3