methyl (E)-6-(4-methylphenyl)sulfonyl-4-oxidanylidene-hept-2-enoate

Systemtic Name: methyl (E)-6-(4-methylphenyl)sulfonyl-4-oxidanylidene-hept-2-enoate Openeye Name: methyl (E)-4-oxo-6-(p-tolylsulfonyl)hept-2-enoate CAS Name: (E)-6-(4-methylphenyl)sulfonyl-4-oxo-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-6-(4-methylphenyl)sulfonyl-4-oxohept-2-enoate Traditional Name: (E)-4-keto-6-tosyl-hept-2-enoic acid methyl ester Formula: C15H18O5S MolecularWeight: 310.36542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C)CC(=O)C=CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C)CC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C15H18O5S/c1-11-4-7-14(8-5-11)21(18,19)12(2)10-13(16)6-9-15(17)20-3/h4-9,12H,10H2,1-3H3/b9-6+