6-(2,2-dimethylpropanoyl)-5,8-dimethyl-2-(methylamino)-4-oxidanylidene-1-pyridin-3-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-(2,2-dimethylpropanoyl)-5,8-dimethyl-2-(methylamino)-4-oxidanylidene-1-pyridin-3-yl-quinoline-3-carboxylic acid Openeye Name: 6-(2,2-dimethylpropanoyl)-5,8-dimethyl-2-(methylamino)-4-oxo-1-(3-pyridyl)quinoline-3-carboxylic acid CAS Name: 6-(2,2-dimethyl-1-oxopropyl)-5,8-dimethyl-2-(methylamino)-4-oxo-1-(3-pyridinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-(2,2-dimethylpropanoyl)-5,8-dimethyl-2-(methylamino)-4-oxo-1-pyridin-3-ylquinoline-3-carboxylic acid Traditional Name: 4-keto-5,8-dimethyl-2-(methylamino)-6-pivaloyl-1-(3-pyridyl)quinoline-3-carboxylic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C(=O)C(C)(C)C)C)C(=O)C(=C(N2C3=CN=CC=C3)NC)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C(=C1)C(=O)C(C)(C)C)C)C(=O)C(=C(N2C3=CN=CC=C3)NC)C(=O)O

InChI

InChI=1S/C23H25N3O4/c1-12-10-15(20(28)23(3,4)5)13(2)16-18(12)26(14-8-7-9-25-11-14)21(24-6)17(19(16)27)22(29)30/h7-11,24H,1-6H3,(H,29,30)