3-(cyclopropylmethylsulfonyl)-4-methoxy-benzoic acid

Systemtic Name: 3-(cyclopropylmethylsulfonyl)-4-methoxy-benzoic acid Openeye Name: 3-(cyclopropylmethylsulfonyl)-4-methoxy-benzoic acid CAS Name: 3-(cyclopropylmethylsulfonyl)-4-methoxybenzoic acid IUPAC Name: 3-(cyclopropylmethylsulfonyl)-4-methoxybenzoic acid Traditional Name: 3-(cyclopropylmethylsulfonyl)-4-methoxy-benzoic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2CC2

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2CC2

InChI

InChI=1S/C12H14O5S/c1-17-10-5-4-9(12(13)14)6-11(10)18(15,16)7-8-2-3-8/h4-6,8H,2-3,7H2,1H3,(H,13,14)