4-(3-carboxy-1-ethyl-6-methyl-4-oxidanylidene-quinolin-7-yl)-2,6-dimethyl-pyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(3-carboxy-1-ethyl-6-methyl-4-oxidanylidene-quinolin-7-yl)-2,6-dimethyl-pyridine-3,5-dicarboxylic acid Openeye Name: 4-(3-carboxy-1-ethyl-6-methyl-4-oxo-7-quinolyl)-2,6-dimethyl-pyridine-3,5-dicarboxylic acid CAS Name: 4-(3-carboxy-1-ethyl-6-methyl-4-oxo-7-quinolinyl)-2,6-dimethylpyridine-3,5-dicarboxylic acid IUPAC Name: 4-(3-carboxy-1-ethyl-6-methyl-4-oxoquinolin-7-yl)-2,6-dimethylpyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-carboxy-1-ethyl-4-keto-6-methyl-7-quinolyl)-2,6-dimethyl-dinicotinic acid Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=C(C(=NC(=C3C(=O)O)C)C)C(=O)O)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=C(C(=NC(=C3C(=O)O)C)C)C(=O)O)C)C(=O)O

InChI

InChI=1S/C22H20N2O7/c1-5-24-8-14(20(26)27)19(25)13-6-9(2)12(7-15(13)24)18-16(21(28)29)10(3)23-11(4)17(18)22(30)31/h6-8H,5H2,1-4H3,(H,26,27)(H,28,29)(H,30,31)