2-(3-bromanyl-4,5-dimethoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(3-bromanyl-4,5-dimethoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(3-bromo-4,5-dimethoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid CAS Name: 2-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(3-bromo-4,5-dimethoxyphenyl)-6-methylquinoline-4-carboxylic acid Traditional Name: 2-(3-bromo-4,5-dimethoxy-phenyl)-6-methyl-cinchoninic acid Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C19H16BrNO4/c1-10-4-5-15-12(6-10)13(19(22)23)9-16(21-15)11-7-14(20)18(25-3)17(8-11)24-2/h4-9H,1-3H3,(H,22,23)