4-(5-azanyl-3-ethoxycarbonyl-6-oxidanylidene-1,2,4-triazin-1-yl)benzoate

Systemtic Name: 4-(5-azanyl-3-ethoxycarbonyl-6-oxidanylidene-1,2,4-triazin-1-yl)benzoate Openeye Name: 4-(5-amino-3-ethoxycarbonyl-6-oxo-1,2,4-triazin-1-yl)benzoate CAS Name: 4-(5-amino-3-ethoxycarbonyl-6-oxo-1,2,4-triazin-1-yl)benzoate IUPAC Name: 4-(5-amino-3-ethoxycarbonyl-6-oxo-1,2,4-triazin-1-yl)benzoate Traditional Name: 4-(5-amino-3-carbethoxy-6-keto-1,2,4-triazin-1-yl)benzoate Formula: C13H11N4O5- MolecularWeight: 303.25024

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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(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=N1)N)C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H12N4O5/c1-2-22-13(21)10-15-9(14)11(18)17(16-10)8-5-3-7(4-6-8)12(19)20/h3-6H,2H2,1H3,(H,19,20)(H2,14,15,16)/p-1