ethyl 2-(5-methyl-6-nitro-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethanoate

Systemtic Name: ethyl 2-(5-methyl-6-nitro-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethanoate Openeye Name: ethyl 2-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetate CAS Name: 2-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetate Traditional Name: 2-(7-keto-5-methyl-6-nitro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid ethyl ester Formula: C10H11N5O5 MolecularWeight: 281.22484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC2=NC(=C(C(=O)N2N1)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CC1=NC2=NC(=C(C(=O)N2N1)[N+](=O)[O-])C

InChI

InChI=1S/C10H11N5O5/c1-3-20-7(16)4-6-12-10-11-5(2)8(15(18)19)9(17)14(10)13-6/h3-4H2,1-2H3,(H,11,12,13)