ethyl 4-bromanyl-3-(1-chloranylpropoxy)-2-methylsulfanyl-benzoate

Systemtic Name: ethyl 4-bromanyl-3-(1-chloranylpropoxy)-2-methylsulfanyl-benzoate Openeye Name: ethyl 4-bromo-3-(1-chloropropoxy)-2-methylsulfanyl-benzoate CAS Name: 4-bromo-3-(1-chloropropoxy)-2-(methylthio)benzoic acid ethyl ester IUPAC Name: ethyl 4-bromo-3-(1-chloropropoxy)-2-methylsulfanylbenzoate Traditional Name: 4-bromo-3-(1-chloropropoxy)-2-(methylthio)benzoic acid ethyl ester Formula: C13H16BrClO3S MolecularWeight: 367.68634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrClO3S/c1-4-10(15)18-11-9(14)7-6-8(12(11)19-3)13(16)17-5-2/h6-7,10H,4-5H2,1-3H3