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3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate

3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate

Systemtic Name:3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate
Openeye Name:3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate
CAS Name:3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate
IUPAC Name:3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate
Traditional Name:3,4,5-trimethoxy-2-nitro-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate
Formula: C12H12N5O6-
MolecularWeight: 322.25358
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=NC2=NC=NN2)[O-])[N+](=O)[O-])OC)OC


Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=NC2=NC=NN2)[O-])[N+](=O)[O-])OC)OC


InChI

InChI=1S/C12H13N5O6/c1-21-7-4-6(11(18)15-12-13-5-14-16-12)8(17(19)20)10(23-3)9(7)22-2/h4-5H,1-3H3,(H2,13,14,15,16,18)/p-1


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