2,4-dimethyl-5-propan-2-ylsulfonyl-benzoic acid

Systemtic Name: 2,4-dimethyl-5-propan-2-ylsulfonyl-benzoic acid Openeye Name: 5-isopropylsulfonyl-2,4-dimethyl-benzoic acid CAS Name: 2,4-dimethyl-5-propan-2-ylsulfonylbenzoic acid IUPAC Name: 2,4-dimethyl-5-propan-2-ylsulfonylbenzoic acid Traditional Name: 5-isopropylsulfonyl-2,4-dimethyl-benzoic acid Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C(C)C)C

InChI

InChI=1S/C12H16O4S/c1-7(2)17(15,16)11-6-10(12(13)14)8(3)5-9(11)4/h5-7H,1-4H3,(H,13,14)