2-chloranyl-3-(4-methoxyphenyl)-4-methylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-3-(4-methoxyphenyl)-4-methylsulfonyl-benzoic acid Openeye Name: 2-chloro-3-(4-methoxyphenyl)-4-methylsulfonyl-benzoic acid CAS Name: 2-chloro-3-(4-methoxyphenyl)-4-methylsulfonylbenzoic acid IUPAC Name: 2-chloro-3-(4-methoxyphenyl)-4-methylsulfonylbenzoic acid Traditional Name: 2-chloro-4-mesyl-3-(4-methoxyphenyl)benzoic acid Formula: C15H13ClO5S MolecularWeight: 340.77872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2Cl)C(=O)O)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2Cl)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C15H13ClO5S/c1-21-10-5-3-9(4-6-10)13-12(22(2,19)20)8-7-11(14(13)16)15(17)18/h3-8H,1-2H3,(H,17,18)