ethyl 2-azanyl-4-[(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)carbonyl]quinoline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)carbonyl]quinoline-3-carboxylate Openeye Name: ethyl 2-amino-4-(3-methyl-5-oxo-1,4-dihydropyrazole-4-carbonyl)quinoline-3-carboxylate CAS Name: 2-amino-4-[(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)-oxomethyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(3-methyl-5-oxo-1,4-dihydropyrazole-4-carbonyl)quinoline-3-carboxylate Traditional Name: 2-amino-4-(3-keto-5-methyl-2-pyrazoline-4-carbonyl)quinoline-3-carboxylic acid ethyl ester Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1N)C(=O)C3C(=NNC3=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1N)C(=O)C3C(=NNC3=O)C

InChI

InChI=1S/C17H16N4O4/c1-3-25-17(24)13-12(14(22)11-8(2)20-21-16(11)23)9-6-4-5-7-10(9)19-15(13)18/h4-7,11H,3H2,1-2H3,(H2,18,19)(H,21,23)