methyl 3-oxidanylidene-4-(4-propan-2-ylphenyl)sulfonyl-butanoate

Systemtic Name: methyl 3-oxidanylidene-4-(4-propan-2-ylphenyl)sulfonyl-butanoate Openeye Name: methyl 4-(4-isopropylphenyl)sulfonyl-3-oxo-butanoate CAS Name: 3-oxo-4-(4-propan-2-ylphenyl)sulfonylbutanoic acid methyl ester IUPAC Name: methyl 3-oxo-4-(4-propan-2-ylphenyl)sulfonylbutanoate Traditional Name: 3-keto-4-p-cumenylsulfonyl-butyric acid methyl ester Formula: C14H18O5S MolecularWeight: 298.35472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O5S/c1-10(2)11-4-6-13(7-5-11)20(17,18)9-12(15)8-14(16)19-3/h4-7,10H,8-9H2,1-3H3