2-(5-bromanyl-1-benzofuran-2-yl)-8-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-bromanyl-1-benzofuran-2-yl)-8-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-bromobenzofuran-2-yl)-8-methyl-quinoline-4-carboxylic acid CAS Name: 2-(5-bromo-2-benzofuranyl)-8-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5-bromo-1-benzofuran-2-yl)-8-methylquinoline-4-carboxylic acid Traditional Name: 2-(5-bromobenzofuran-2-yl)-8-methyl-cinchoninic acid Formula: C19H12BrNO3 MolecularWeight: 382.20748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C19H12BrNO3/c1-10-3-2-4-13-14(19(22)23)9-15(21-18(10)13)17-8-11-7-12(20)5-6-16(11)24-17/h2-9H,1H3,(H,22,23)