8-bromanyl-2-(4-methoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-(4-methoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(4-methoxyphenyl)cinchoninic acid Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O

InChI

InChI=1S/C17H12BrNO3/c1-22-11-7-5-10(6-8-11)15-9-13(17(20)21)12-3-2-4-14(18)16(12)19-15/h2-9H,1H3,(H,20,21)