2-[2,6-bis(bromanyl)-4-methyl-phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2,6-bis(bromanyl)-4-methyl-phenyl]sulfanylethanoic acid Openeye Name: 2-(2,6-dibromo-4-methyl-phenyl)sulfanylacetic acid CAS Name: 2-[(2,6-dibromo-4-methylphenyl)thio]acetic acid IUPAC Name: 2-(2,6-dibromo-4-methylphenyl)sulfanylacetic acid Traditional Name: 2-[(2,6-dibromo-4-methyl-phenyl)thio]acetic acid Formula: C9H8Br2O2S MolecularWeight: 340.03162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)SCC(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)SCC(=O)O)Br

InChI

InChI=1S/C9H8Br2O2S/c1-5-2-6(10)9(7(11)3-5)14-4-8(12)13/h2-3H,4H2,1H3,(H,12,13)