2-[5-(4-bromanyl-3-chloranyl-phenyl)furan-2-yl]quinoline-4-carboxylic acid

Systemtic Name: 2-[5-(4-bromanyl-3-chloranyl-phenyl)furan-2-yl]quinoline-4-carboxylic acid Openeye Name: 2-[5-(4-bromo-3-chloro-phenyl)-2-furyl]quinoline-4-carboxylic acid CAS Name: 2-[5-(4-bromo-3-chlorophenyl)-2-furanyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[5-(4-bromo-3-chlorophenyl)furan-2-yl]quinoline-4-carboxylic acid Traditional Name: 2-[5-(4-bromo-3-chloro-phenyl)-2-furyl]cinchoninic acid Formula: C20H11BrClNO3 MolecularWeight: 428.66324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(O3)C4=CC(=C(C=C4)Br)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(O3)C4=CC(=C(C=C4)Br)Cl)C(=O)O

InChI

InChI=1S/C20H11BrClNO3/c21-14-6-5-11(9-15(14)22)18-7-8-19(26-18)17-10-13(20(24)25)12-3-1-2-4-16(12)23-17/h1-10H,(H,24,25)