2-(3-methyl-4-methylsulfanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-methyl-4-methylsulfanyl-phenyl)ethanoic acid Openeye Name: 2-(3-methyl-4-methylsulfanyl-phenyl)acetic acid CAS Name: 2-[3-methyl-4-(methylthio)phenyl]acetic acid IUPAC Name: 2-(3-methyl-4-methylsulfanylphenyl)acetic acid Traditional Name: 2-[3-methyl-4-(methylthio)phenyl]acetic acid Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O2S/c1-7-5-8(6-10(11)12)3-4-9(7)13-2/h3-5H,6H2,1-2H3,(H,11,12)