2-[4-[N-cyano-N-(4-nitrophenyl)carbamimidoyl]pyridin-2-yl]ethyl nitrate

Systemtic Name: 2-[4-[N-cyano-N-(4-nitrophenyl)carbamimidoyl]pyridin-2-yl]ethyl nitrate Openeye Name: 2-[4-[N-cyano-N-(4-nitrophenyl)carbamimidoyl]-2-pyridyl]ethyl nitrate CAS Name: nitric acid 2-[4-[(N-cyano-4-nitroanilino)-iminomethyl]-2-pyridinyl]ethyl ester IUPAC Name: 2-[4-[N-cyano-N-(4-nitrophenyl)carbamimidoyl]pyridin-2-yl]ethyl nitrate Traditional Name: nitric acid 2-[4-[N-cyano-N-(4-nitrophenyl)amidino]-2-pyridyl]ethyl ester Formula: C15H12N6O5 MolecularWeight: 356.29298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(C#N)C(=N)C2=CC(=NC=C2)CCO[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N(C#N)C(=N)C2=CC(=NC=C2)CCO[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N6O5/c16-10-19(13-1-3-14(4-2-13)20(22)23)15(17)11-5-7-18-12(9-11)6-8-26-21(24)25/h1-5,7,9,17H,6,8H2