8-bromanyl-2-(3-chloranyl-4-methoxy-phenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-(3-chloranyl-4-methoxy-phenyl)quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(3-chloro-4-methoxy-phenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(3-chloro-4-methoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(3-chloro-4-methoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(3-chloro-4-methoxy-phenyl)cinchoninic acid Formula: C17H11BrClNO3 MolecularWeight: 392.63114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrClNO3/c1-23-15-6-5-9(7-13(15)19)14-8-11(17(21)22)10-3-2-4-12(18)16(10)20-14/h2-8H,1H3,(H,21,22)