2-(4-carboxy-5-methyl-quinolin-3-yl)-8-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-carboxy-5-methyl-quinolin-3-yl)-8-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-carboxy-5-methyl-3-quinolyl)-8-methyl-quinoline-4-carboxylic acid CAS Name: 2-(4-carboxy-5-methyl-3-quinolinyl)-8-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-carboxy-5-methylquinolin-3-yl)-8-methylquinoline-4-carboxylic acid Traditional Name: 2-(4-carboxy-5-methyl-3-quinolyl)-8-methyl-cinchoninic acid Formula: C22H16N2O4 MolecularWeight: 372.37344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=CC(=C2C(=O)O)C3=NC4=C(C=CC=C4C)C(=C3)C(=O)O

Isomeric SMILES

CC1=C2C(=CC=C1)N=CC(=C2C(=O)O)C3=NC4=C(C=CC=C4C)C(=C3)C(=O)O

InChI

InChI=1S/C22H16N2O4/c1-11-5-4-8-16-18(11)19(22(27)28)15(10-23-16)17-9-14(21(25)26)13-7-3-6-12(2)20(13)24-17/h3-10H,1-2H3,(H,25,26)(H,27,28)