ethyl N-nitroso-N-[4-(6-oxidanylidene-3H-purin-9-yl)butyl]carbamate

Systemtic Name: ethyl N-nitroso-N-[4-(6-oxidanylidene-3H-purin-9-yl)butyl]carbamate Openeye Name: ethyl N-nitroso-N-[4-(6-oxo-3H-purin-9-yl)butyl]carbamate CAS Name: N-nitroso-N-[4-(6-oxo-3H-purin-9-yl)butyl]carbamic acid ethyl ester IUPAC Name: ethyl N-nitroso-N-[4-(6-oxo-3H-purin-9-yl)butyl]carbamate Traditional Name: N-[4-(6-keto-3H-purin-9-yl)butyl]-N-nitroso-carbamic acid ethyl ester Formula: C12H16N6O4 MolecularWeight: 308.29324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CCCCN1C=NC2=C1NC=NC2=O)N=O

Isomeric SMILES

CCOC(=O)N(CCCCN1C=NC2=C1NC=NC2=O)N=O

InChI

InChI=1S/C12H16N6O4/c1-2-22-12(20)18(16-21)6-4-3-5-17-8-15-9-10(17)13-7-14-11(9)19/h7-8H,2-6H2,1H3,(H,13,14,19)