4-[4-(2-chloranylethanoyl)phenoxy]-3-methylsulfonyl-benzoic acid

Systemtic Name: 4-[4-(2-chloranylethanoyl)phenoxy]-3-methylsulfonyl-benzoic acid Openeye Name: 4-[4-(2-chloroacetyl)phenoxy]-3-methylsulfonyl-benzoic acid CAS Name: 4-[4-(2-chloro-1-oxoethyl)phenoxy]-3-methylsulfonylbenzoic acid IUPAC Name: 4-[4-(2-chloroacetyl)phenoxy]-3-methylsulfonylbenzoic acid Traditional Name: 4-[4-(2-chloroacetyl)phenoxy]-3-mesyl-benzoic acid Formula: C16H13ClO6S MolecularWeight: 368.78882

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC2=CC=C(C=C2)C(=O)CCl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC2=CC=C(C=C2)C(=O)CCl

InChI

InChI=1S/C16H13ClO6S/c1-24(21,22)15-8-11(16(19)20)4-7-14(15)23-12-5-2-10(3-6-12)13(18)9-17/h2-8H,9H2,1H3,(H,19,20)