5-cyclopentylsulfonyl-2-methyl-benzoic acid

Systemtic Name: 5-cyclopentylsulfonyl-2-methyl-benzoic acid Openeye Name: 5-cyclopentylsulfonyl-2-methyl-benzoic acid CAS Name: 5-cyclopentylsulfonyl-2-methylbenzoic acid IUPAC Name: 5-cyclopentylsulfonyl-2-methylbenzoic acid Traditional Name: 5-cyclopentylsulfonyl-2-methyl-benzoic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2CCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2CCCC2)C(=O)O

InChI

InChI=1S/C13H16O4S/c1-9-6-7-11(8-12(9)13(14)15)18(16,17)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,14,15)