2-[6-(bromomethyl)quinolin-2-yl]benzoic acid

Systemtic Name: 2-[6-(bromomethyl)quinolin-2-yl]benzoic acid Openeye Name: 2-[6-(bromomethyl)-2-quinolyl]benzoic acid CAS Name: 2-[6-(bromomethyl)-2-quinolinyl]benzoic acid IUPAC Name: 2-[6-(bromomethyl)quinolin-2-yl]benzoic acid Traditional Name: 2-[6-(bromomethyl)-2-quinolyl]benzoic acid Formula: C17H12BrNO2 MolecularWeight: 342.18668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=C2)C=C(C=C3)CBr)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=C2)C=C(C=C3)CBr)C(=O)O

InChI

InChI=1S/C17H12BrNO2/c18-10-11-5-7-15-12(9-11)6-8-16(19-15)13-3-1-2-4-14(13)17(20)21/h1-9H,10H2,(H,20,21)