4-methoxy-3-propan-2-ylsulfonyl-benzoic acid

Systemtic Name: 4-methoxy-3-propan-2-ylsulfonyl-benzoic acid Openeye Name: 3-isopropylsulfonyl-4-methoxy-benzoic acid CAS Name: 4-methoxy-3-propan-2-ylsulfonylbenzoic acid IUPAC Name: 4-methoxy-3-propan-2-ylsulfonylbenzoic acid Traditional Name: 3-isopropylsulfonyl-4-methoxy-benzoic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O5S/c1-7(2)17(14,15)10-6-8(11(12)13)4-5-9(10)16-3/h4-7H,1-3H3,(H,12,13)