8-bromanyl-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(3,4-dimethoxyphenyl)cinchoninic acid Formula: C18H14BrNO4 MolecularWeight: 388.21206

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrNO4/c1-23-15-7-6-10(8-16(15)24-2)14-9-12(18(21)22)11-4-3-5-13(19)17(11)20-14/h3-9H,1-2H3,(H,21,22)