4-ethyl-3-prop-2-enylsulfonyl-benzoic acid

Systemtic Name: 4-ethyl-3-prop-2-enylsulfonyl-benzoic acid Openeye Name: 3-allylsulfonyl-4-ethyl-benzoic acid CAS Name: 4-ethyl-3-prop-2-enylsulfonylbenzoic acid IUPAC Name: 4-ethyl-3-prop-2-enylsulfonylbenzoic acid Traditional Name: 3-allylsulfonyl-4-ethyl-benzoic acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O4S/c1-3-7-17(15,16)11-8-10(12(13)14)6-5-9(11)4-2/h3,5-6,8H,1,4,7H2,2H3,(H,13,14)