3-cyclopentylsulfonyl-4-ethyl-benzoic acid

Systemtic Name: 3-cyclopentylsulfonyl-4-ethyl-benzoic acid Openeye Name: 3-cyclopentylsulfonyl-4-ethyl-benzoic acid CAS Name: 3-cyclopentylsulfonyl-4-ethylbenzoic acid IUPAC Name: 3-cyclopentylsulfonyl-4-ethylbenzoic acid Traditional Name: 3-cyclopentylsulfonyl-4-ethyl-benzoic acid Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)C2CCCC2

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)C2CCCC2

InChI

InChI=1S/C14H18O4S/c1-2-10-7-8-11(14(15)16)9-13(10)19(17,18)12-5-3-4-6-12/h7-9,12H,2-6H2,1H3,(H,15,16)