2-[4-methyl-2,5-bis(oxidanyl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-methyl-2,5-bis(oxidanyl)phenyl]sulfanylethanoic acid Openeye Name: 2-(2,5-dihydroxy-4-methyl-phenyl)sulfanylacetic acid CAS Name: 2-[(2,5-dihydroxy-4-methylphenyl)thio]acetic acid IUPAC Name: 2-(2,5-dihydroxy-4-methylphenyl)sulfanylacetic acid Traditional Name: 2-[(2,5-dihydroxy-4-methyl-phenyl)thio]acetic acid Formula: C9H10O4S MolecularWeight: 214.2383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)SCC(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1O)SCC(=O)O)O

InChI

InChI=1S/C9H10O4S/c1-5-2-7(11)8(3-6(5)10)14-4-9(12)13/h2-3,10-11H,4H2,1H3,(H,12,13)