4-(4-chlorophenyl)-3-(4-methylphenyl)sulfonyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)sulfonyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chlorophenyl)-4-oxo-3-(p-tolylsulfonyl)butanoic acid CAS Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)sulfonyl-4-oxobutanoic acid IUPAC Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)sulfonyl-4-oxobutanoic acid Traditional Name: 4-(4-chlorophenyl)-4-keto-3-tosyl-butyric acid Formula: C17H15ClO5S MolecularWeight: 366.816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(=O)O)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(=O)O)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClO5S/c1-11-2-8-14(9-3-11)24(22,23)15(10-16(19)20)17(21)12-4-6-13(18)7-5-12/h2-9,15H,10H2,1H3,(H,19,20)