ethyl 4-(6-chloranylquinoxalin-2-yl)-2-methyl-3-oxidanylidene-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-(6-chloranylquinoxalin-2-yl)-2-methyl-3-oxidanylidene-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-(6-chloroquinoxalin-2-yl)-2-methyl-3-oxo-1H-pyrazole-5-carboxylate CAS Name: 4-(6-chloro-2-quinoxalinyl)-2-methyl-3-oxo-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-chloroquinoxalin-2-yl)-2-methyl-3-oxo-1H-pyrazole-5-carboxylate Traditional Name: 4-(6-chloroquinoxalin-2-yl)-5-keto-1-methyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C15H13ClN4O3 MolecularWeight: 332.74172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1)C)C2=CN=C3C=C(C=CC3=N2)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1)C)C2=CN=C3C=C(C=CC3=N2)Cl

InChI

InChI=1S/C15H13ClN4O3/c1-3-23-15(22)13-12(14(21)20(2)19-13)11-7-17-10-6-8(16)4-5-9(10)18-11/h4-7,19H,3H2,1-2H3