[(5S)-1,3-dimethyl-5-nitro-1,3-diazinan-1-ium-5-yl]methanol

Systemtic Name: [(5S)-1,3-dimethyl-5-nitro-1,3-diazinan-1-ium-5-yl]methanol Openeye Name: [(5S)-1,3-dimethyl-5-nitro-hexahydropyrimidin-1-ium-5-yl]methanol CAS Name: [(5S)-1,3-dimethyl-5-nitro-1,3-diazinan-1-ium-5-yl]methanol IUPAC Name: [(5S)-1,3-dimethyl-5-nitro-1,3-diazinan-1-ium-5-yl]methanol Traditional Name: [(5S)-1,3-dimethyl-5-nitro-hexahydropyrimidin-1-ium-5-yl]methanol Formula: C7H16N3O3+ MolecularWeight: 190.22024

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(CN(C1)C)(CO)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1C[C@@](CN(C1)C)(CO)[N+](=O)[O-]

InChI

InChI=1S/C7H15N3O3/c1-8-3-7(5-11,10(12)13)4-9(2)6-8/h11H,3-6H2,1-2H3/p+1