3-chloranylsulfonyl-2,4,6-trimethyl-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-2,4,6-trimethyl-benzoic acid Openeye Name: 3-chlorosulfonyl-2,4,6-trimethyl-benzoic acid CAS Name: 3-chlorosulfonyl-2,4,6-trimethylbenzoic acid IUPAC Name: 3-chlorosulfonyl-2,4,6-trimethylbenzoic acid Traditional Name: 3-chlorosulfonyl-2,4,6-trimethyl-benzoic acid Formula: C10H11ClO4S MolecularWeight: 262.70994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)O)C)S(=O)(=O)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)O)C)S(=O)(=O)Cl)C

InChI

InChI=1S/C10H11ClO4S/c1-5-4-6(2)9(16(11,14)15)7(3)8(5)10(12)13/h4H,1-3H3,(H,12,13)