6-[3-methyl-2,6-bis(oxidanylidene)-7-propyl-purin-1-yl]hexan-2-yl nitrate

Systemtic Name: 6-[3-methyl-2,6-bis(oxidanylidene)-7-propyl-purin-1-yl]hexan-2-yl nitrate Openeye Name: [1-methyl-5-(3-methyl-2,6-dioxo-7-propyl-purin-1-yl)pentyl] nitrate CAS Name: nitric acid 6-(3-methyl-2,6-dioxo-7-propyl-1-purinyl)hexan-2-yl ester IUPAC Name: 6-(3-methyl-2,6-dioxo-7-propylpurin-1-yl)hexan-2-yl nitrate Traditional Name: nitric acid [5-(2,6-diketo-3-methyl-7-propyl-purin-1-yl)-1-methyl-pentyl] ester Formula: C15H23N5O5 MolecularWeight: 353.37362

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(C)O[N+](=O)[O-]

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(C)O[N+](=O)[O-]

InChI

InChI=1S/C15H23N5O5/c1-4-8-18-10-16-13-12(18)14(21)19(15(22)17(13)3)9-6-5-7-11(2)25-20(23)24/h10-11H,4-9H2,1-3H3