4-azanyl-1-[2-nitro-1-(oxan-2-yloxy)propan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[2-nitro-1-(oxan-2-yloxy)propan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-(1-methyl-1-nitro-2-tetrahydropyran-2-yloxy-ethyl)pyrimidin-2-one CAS Name: 4-amino-1-[2-nitro-1-(2-oxanyloxy)propan-2-yl]-2-pyrimidinone IUPAC Name: 4-amino-1-[2-nitro-1-(oxan-2-yloxy)propan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-(1-methyl-1-nitro-2-tetrahydropyran-2-yloxy-ethyl)pyrimidin-2-one Formula: C12H18N4O5 MolecularWeight: 298.29512

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1CCCCO1)(N2C=CC(=NC2=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(COC1CCCCO1)(N2C=CC(=NC2=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O5/c1-12(16(18)19,8-21-10-4-2-3-7-20-10)15-6-5-9(13)14-11(15)17/h5-6,10H,2-4,7-8H2,1H3,(H2,13,14,17)