3-iodanyl-3-(4-methylphenyl)sulfonyl-propanoic acid

Systemtic Name: 3-iodanyl-3-(4-methylphenyl)sulfonyl-propanoic acid Openeye Name: 3-iodo-3-(p-tolylsulfonyl)propanoic acid CAS Name: 3-iodo-3-(4-methylphenyl)sulfonylpropanoic acid IUPAC Name: 3-iodo-3-(4-methylphenyl)sulfonylpropanoic acid Traditional Name: 3-iodo-3-tosyl-propionic acid Formula: C10H11IO4S MolecularWeight: 354.16141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11IO4S/c1-7-2-4-8(5-3-7)16(14,15)9(11)6-10(12)13/h2-5,9H,6H2,1H3,(H,12,13)