3-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-2-methyl-quinoline-4-carboxylic acid

Systemtic Name: 3-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-2-methyl-quinoline-4-carboxylic acid Openeye Name: 3-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-2-methyl-quinoline-4-carboxylic acid CAS Name: 3-(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)-2-methyl-4-quinolinecarboxylic acid IUPAC Name: 3-(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)-2-methylquinoline-4-carboxylic acid Traditional Name: 3-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)-2-methyl-cinchoninic acid Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=C(C4=CC=CC=C4N=C3C)C(=O)O)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1C3=C(C4=CC=CC=C4N=C3C)C(=O)O)N=C(C=C2C)C

InChI

InChI=1S/C21H20N4O2/c1-5-16-24-18-11(2)10-12(3)22-20(18)25(16)19-13(4)23-15-9-7-6-8-14(15)17(19)21(26)27/h6-10H,5H2,1-4H3,(H,26,27)