4-[(2-azanyl-3-oxidanyl-pyrimidin-4-ylidene)amino]butyl nitrate

Systemtic Name: 4-[(2-azanyl-3-oxidanyl-pyrimidin-4-ylidene)amino]butyl nitrate Openeye Name: 4-[(2-amino-3-hydroxy-pyrimidin-4-ylidene)amino]butyl nitrate CAS Name: nitric acid 4-[(2-amino-3-hydroxy-4-pyrimidinylidene)amino]butyl ester IUPAC Name: 4-[(2-amino-3-hydroxypyrimidin-4-ylidene)amino]butyl nitrate Traditional Name: nitric acid 4-[(2-amino-3-hydroxy-pyrimidin-4-ylidene)amino]butyl ester Formula: C8H13N5O4 MolecularWeight: 243.21992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N(C1=NCCCCO[N+](=O)[O-])O)N

Isomeric SMILES

C1=CN=C(N(C1=NCCCCO[N+](=O)[O-])O)N

InChI

InChI=1S/C8H13N5O4/c9-8-11-5-3-7(12(8)14)10-4-1-2-6-17-13(15)16/h3,5,14H,1-2,4,6H2,(H2,9,11)