(2-bromanyl-4,5-dimethoxy-phenyl)methyl quinoline-2-carboxylate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl quinoline-2-carboxylate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2=NC3=CC=CC=C3C=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)C2=NC3=CC=CC=C3C=C2)Br)OC

InChI

InChI=1S/C19H16BrNO4/c1-23-17-9-13(14(20)10-18(17)24-2)11-25-19(22)16-8-7-12-5-3-4-6-15(12)21-16/h3-10H,11H2,1-2H3