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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)C

Isomeric SMILES

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)C

InChI

InChI=1S/C21H20N2O3/c1-11-8-14(9-22-13(11)3)16-6-7-17-19(12(16)2)23(15-4-5-15)10-18(20(17)24)21(25)26/h6-10,15H,4-5H2,1-3H3,(H,25,26)