(3-nitro-4-oxidanylidene-phthalazin-1-yl)methyl nitrate

Systemtic Name: (3-nitro-4-oxidanylidene-phthalazin-1-yl)methyl nitrate Openeye Name: (3-nitro-4-oxo-phthalazin-1-yl)methyl nitrate CAS Name: nitric acid (3-nitro-4-oxo-1-phthalazinyl)methyl ester IUPAC Name: (3-nitro-4-oxophthalazin-1-yl)methyl nitrate Traditional Name: nitric acid (4-keto-3-nitro-phthalazin-1-yl)methyl ester Formula: C9H6N4O6 MolecularWeight: 266.16714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)[N+](=O)[O-])CO[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)[N+](=O)[O-])CO[N+](=O)[O-]

InChI

InChI=1S/C9H6N4O6/c14-9-7-4-2-1-3-6(7)8(5-19-13(17)18)10-11(9)12(15)16/h1-4H,5H2