2-chloranyl-4-methyl-benzenesulfonic acid

Systemtic Name: 2-chloranyl-4-methyl-benzenesulfonic acid Openeye Name: 2-chloro-4-methyl-benzenesulfonic acid CAS Name: 2-chloro-4-methylbenzenesulfonic acid IUPAC Name: 2-chloro-4-methylbenzenesulfonic acid Traditional Name: 2-chloro-4-methyl-besylic acid Formula: C7H7ClO3S MolecularWeight: 206.64668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7ClO3S/c1-5-2-3-7(6(8)4-5)12(9,10)11/h2-4H,1H3,(H,9,10,11)