2-[1,3-diethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl nitrate

Systemtic Name: 2-[1,3-diethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl nitrate Openeye Name: 2-(1,3-diethyl-2,6-dioxo-purin-7-yl)ethyl nitrate CAS Name: nitric acid 2-(1,3-diethyl-2,6-dioxo-7-purinyl)ethyl ester IUPAC Name: 2-(1,3-diethyl-2,6-dioxopurin-7-yl)ethyl nitrate Traditional Name: nitric acid 2-(1,3-diethyl-2,6-diketo-purin-7-yl)ethyl ester Formula: C11H15N5O5 MolecularWeight: 297.2673

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CCO[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CCO[N+](=O)[O-]

InChI

InChI=1S/C11H15N5O5/c1-3-14-9-8(10(17)15(4-2)11(14)18)13(7-12-9)5-6-21-16(19)20/h7H,3-6H2,1-2H3