ethyl 5-azanyl-1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-1,2,4-triazine-3-carboxylate

Systemtic Name: ethyl 5-azanyl-1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-1,2,4-triazine-3-carboxylate Openeye Name: ethyl 5-amino-1-(3-chloro-4-methyl-phenyl)-6-oxo-1,2,4-triazine-3-carboxylate CAS Name: 5-amino-1-(3-chloro-4-methylphenyl)-6-oxo-1,2,4-triazine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-(3-chloro-4-methylphenyl)-6-oxo-1,2,4-triazine-3-carboxylate Traditional Name: 5-amino-1-(3-chloro-4-methyl-phenyl)-6-keto-1,2,4-triazine-3-carboxylic acid ethyl ester Formula: C13H13ClN4O3 MolecularWeight: 308.72032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C(=N1)N)C2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=N1)N)C2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C13H13ClN4O3/c1-3-21-13(20)11-16-10(15)12(19)18(17-11)8-5-4-7(2)9(14)6-8/h4-6H,3H2,1-2H3,(H2,15,16,17)