4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]-5-nitro-1H-pyrimidin-6-one

Systemtic Name: 4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]-5-nitro-1H-pyrimidin-6-one Openeye Name: 4-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethoxy]-5-nitro-1H-pyrimidin-6-one CAS Name: 4-[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethoxy]-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethoxy]-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-[2-keto-2-[(2S)-2-methylpiperidino]ethoxy]-5-nitro-1H-pyrimidin-6-one Formula: C12H16N4O5 MolecularWeight: 296.27924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O5/c1-8-4-2-3-5-15(8)9(17)6-21-12-10(16(19)20)11(18)13-7-14-12/h7-8H,2-6H2,1H3,(H,13,14,18)/t8-/m0/s1