4-(methylsulfinylmethyl)benzoic acid

Systemtic Name: 4-(methylsulfinylmethyl)benzoic acid Openeye Name: 4-(methylsulfinylmethyl)benzoic acid CAS Name: 4-(methylsulfinylmethyl)benzoic acid IUPAC Name: 4-(methylsulfinylmethyl)benzoic acid Traditional Name: 4-(methylsulfinylmethyl)benzoic acid Formula: C9H10O3S MolecularWeight: 198.2389

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CS(=O)CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C9H10O3S/c1-13(12)6-7-2-4-8(5-3-7)9(10)11/h2-5H,6H2,1H3,(H,10,11)