4-azanylidene-5-nitroso-1-oxidanyl-3-pentyl-pyrimidin-2-one

Systemtic Name: 4-azanylidene-5-nitroso-1-oxidanyl-3-pentyl-pyrimidin-2-one Openeye Name: 1-hydroxy-4-imino-5-nitroso-3-pentyl-pyrimidin-2-one CAS Name: 1-hydroxy-4-imino-5-nitroso-3-pentyl-2-pyrimidinone IUPAC Name: 1-hydroxy-4-imino-5-nitroso-3-pentylpyrimidin-2-one Traditional Name: 3-amyl-1-hydroxy-4-imino-5-nitroso-pyrimidin-2-one Formula: C9H14N4O3 MolecularWeight: 226.23246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=N)C(=CN(C1=O)O)N=O

Isomeric SMILES

CCCCCN1C(=N)C(=CN(C1=O)O)N=O

InChI

InChI=1S/C9H14N4O3/c1-2-3-4-5-12-8(10)7(11-15)6-13(16)9(12)14/h6,10,16H,2-5H2,1H3