4-ethyl-2,3-dimethyl-benzenesulfonic acid

Systemtic Name: 4-ethyl-2,3-dimethyl-benzenesulfonic acid Openeye Name: 4-ethyl-2,3-dimethyl-benzenesulfonic acid CAS Name: 4-ethyl-2,3-dimethylbenzenesulfonic acid IUPAC Name: 4-ethyl-2,3-dimethylbenzenesulfonic acid Traditional Name: 4-ethyl-2,3-dimethyl-besylic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3S/c1-4-9-5-6-10(14(11,12)13)8(3)7(9)2/h5-6H,4H2,1-3H3,(H,11,12,13)