1-cyclopropyl-5,8-dimethyl-7-(6-methylpyridin-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-5,8-dimethyl-7-(6-methylpyridin-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-5,8-dimethyl-7-(6-methyl-3-pyridyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-5,8-dimethyl-7-(6-methyl-3-pyridinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-5,8-dimethyl-7-(6-methylpyridin-3-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-5,8-dimethyl-7-(6-methyl-3-pyridyl)quinoline-3-carboxylic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=CC(=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)C

Isomeric SMILES

CC1=NC=C(C=C1)C2=CC(=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)C

InChI

InChI=1S/C21H20N2O3/c1-11-8-16(14-5-4-12(2)22-9-14)13(3)19-18(11)20(24)17(21(25)26)10-23(19)15-6-7-15/h4-5,8-10,15H,6-7H2,1-3H3,(H,25,26)