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3-chloranylsulfonyl-4-methyl-benzoic acid

3-chloranylsulfonyl-4-methyl-benzoic acid

Systemtic Name:3-chloranylsulfonyl-4-methyl-benzoic acid
Openeye Name:3-chlorosulfonyl-4-methyl-benzoic acid
CAS Name:3-chlorosulfonyl-4-methylbenzoic acid
IUPAC Name:3-chlorosulfonyl-4-methylbenzoic acid
Traditional Name:3-chlorosulfonyl-4-methyl-benzoic acid
Formula: C8H7ClO4S
MolecularWeight: 234.65678
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H7ClO4S/c1-5-2-3-6(8(10)11)4-7(5)14(9,12)13/h2-4H,1H3,(H,10,11)


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