2-(8-bromanylquinolin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(8-bromanylquinolin-4-yl)sulfanylethanoic acid Openeye Name: 2-[(8-bromo-4-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(8-bromo-4-quinolinyl)thio]acetic acid IUPAC Name: 2-(8-bromoquinolin-4-yl)sulfanylacetic acid Traditional Name: 2-[(8-bromo-4-quinolyl)thio]acetic acid Formula: C11H8BrNO2S MolecularWeight: 298.15572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C(=C1)Br)SCC(=O)O

Isomeric SMILES

C1=CC2=C(C=CN=C2C(=C1)Br)SCC(=O)O

InChI

InChI=1S/C11H8BrNO2S/c12-8-3-1-2-7-9(16-6-10(14)15)4-5-13-11(7)8/h1-5H,6H2,(H,14,15)