4-bromanyl-3-(1-chloranylpropoxy)-2-methylsulfanyl-benzoic acid

Systemtic Name: 4-bromanyl-3-(1-chloranylpropoxy)-2-methylsulfanyl-benzoic acid Openeye Name: 4-bromo-3-(1-chloropropoxy)-2-methylsulfanyl-benzoic acid CAS Name: 4-bromo-3-(1-chloropropoxy)-2-(methylthio)benzoic acid IUPAC Name: 4-bromo-3-(1-chloropropoxy)-2-methylsulfanylbenzoic acid Traditional Name: 4-bromo-3-(1-chloropropoxy)-2-(methylthio)benzoic acid Formula: C11H12BrClO3S MolecularWeight: 339.63318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=C(C=CC(=C1SC)C(=O)O)Br)Cl

Isomeric SMILES

CCC(OC1=C(C=CC(=C1SC)C(=O)O)Br)Cl

InChI

InChI=1S/C11H12BrClO3S/c1-3-8(13)16-9-7(12)5-4-6(11(14)15)10(9)17-2/h4-5,8H,3H2,1-2H3,(H,14,15)