5-(2-chloroethylsulfonyl)-2-methyl-benzoic acid

Systemtic Name: 5-(2-chloroethylsulfonyl)-2-methyl-benzoic acid Openeye Name: 5-(2-chloroethylsulfonyl)-2-methyl-benzoic acid CAS Name: 5-(2-chloroethylsulfonyl)-2-methylbenzoic acid IUPAC Name: 5-(2-chloroethylsulfonyl)-2-methylbenzoic acid Traditional Name: 5-(2-chloroethylsulfonyl)-2-methyl-benzoic acid Formula: C10H11ClO4S MolecularWeight: 262.70994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CCCl)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CCCl)C(=O)O

InChI

InChI=1S/C10H11ClO4S/c1-7-2-3-8(6-9(7)10(12)13)16(14,15)5-4-11/h2-3,6H,4-5H2,1H3,(H,12,13)