1-ethyl-7-(2-methylpyrimidin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-(2-methylpyrimidin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-(2-methylpyrimidin-4-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-(2-methyl-4-pyrimidinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-(2-methylpyrimidin-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-4-keto-7-(2-methylpyrimidin-4-yl)quinoline-3-carboxylic acid Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=NC(=NC=C3)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=NC(=NC=C3)C)C(=O)O

InChI

InChI=1S/C17H15N3O3/c1-3-20-9-13(17(22)23)16(21)12-5-4-11(8-15(12)20)14-6-7-18-10(2)19-14/h4-9H,3H2,1-2H3,(H,22,23)