dimethyl 2-[2-(phenylsulfonyl)buta-2,3-dienyl]propanedioate

Systemtic Name: dimethyl 2-[2-(phenylsulfonyl)buta-2,3-dienyl]propanedioate Openeye Name: dimethyl 2-[2-(benzenesulfonyl)buta-2,3-dienyl]propanedioate CAS Name: 2-[2-(benzenesulfonyl)buta-2,3-dienyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-(benzenesulfonyl)buta-2,3-dienyl]propanedioate Traditional Name: 2-(2-besylbuta-2,3-dienyl)malonic acid dimethyl ester Formula: C15H16O6S MolecularWeight: 324.34894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=C=C)S(=O)(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(CC(=C=C)S(=O)(=O)C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C15H16O6S/c1-4-11(10-13(14(16)20-2)15(17)21-3)22(18,19)12-8-6-5-7-9-12/h5-9,13H,1,10H2,2-3H3