2-[(2-azanylidene-5-nitro-pyridin-1-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(2-azanylidene-5-nitro-pyridin-1-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(2-imino-5-nitro-1-pyridyl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(2-imino-5-nitro-1-pyridinyl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(2-imino-5-nitropyridin-1-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(2-imino-5-nitro-1-pyridyl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C14H9N5O6 MolecularWeight: 343.25116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CN3C=C(C=CC3=N)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CN3C=C(C=CC3=N)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O6/c15-12-4-2-9(19(24)25)6-16(12)7-17-13(20)10-3-1-8(18(22)23)5-11(10)14(17)21/h1-6,15H,7H2