4-(3-chloranylsulfonyl-4-methyl-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3-chloranylsulfonyl-4-methyl-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-chlorosulfonyl-4-methyl-phenyl)-4-oxo-butanoic acid CAS Name: 4-(3-chlorosulfonyl-4-methylphenyl)-4-oxobutanoic acid IUPAC Name: 4-(3-chlorosulfonyl-4-methylphenyl)-4-oxobutanoic acid Traditional Name: 4-(3-chlorosulfonyl-4-methyl-phenyl)-4-keto-butyric acid Formula: C11H11ClO5S MolecularWeight: 290.72004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C11H11ClO5S/c1-7-2-3-8(6-10(7)18(12,16)17)9(13)4-5-11(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)