ethyl N-nitroso-N-[6-(6-oxidanylidene-3H-purin-9-yl)hexyl]carbamate

Systemtic Name: ethyl N-nitroso-N-[6-(6-oxidanylidene-3H-purin-9-yl)hexyl]carbamate Openeye Name: ethyl N-nitroso-N-[6-(6-oxo-3H-purin-9-yl)hexyl]carbamate CAS Name: N-nitroso-N-[6-(6-oxo-3H-purin-9-yl)hexyl]carbamic acid ethyl ester IUPAC Name: ethyl N-nitroso-N-[6-(6-oxo-3H-purin-9-yl)hexyl]carbamate Traditional Name: N-[6-(6-keto-3H-purin-9-yl)hexyl]-N-nitroso-carbamic acid ethyl ester Formula: C14H20N6O4 MolecularWeight: 336.3464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CCCCCCN1C=NC2=C1NC=NC2=O)N=O

Isomeric SMILES

CCOC(=O)N(CCCCCCN1C=NC2=C1NC=NC2=O)N=O

InChI

InChI=1S/C14H20N6O4/c1-2-24-14(22)20(18-23)8-6-4-3-5-7-19-10-17-11-12(19)15-9-16-13(11)21/h9-10H,2-8H2,1H3,(H,15,16,21)