[(5S)-5-nitro-1,3-di(propan-2-yl)-1,3-diazinan-1-ium-5-yl]methanol

Systemtic Name: [(5S)-5-nitro-1,3-di(propan-2-yl)-1,3-diazinan-1-ium-5-yl]methanol Openeye Name: [(5S)-1,3-diisopropyl-5-nitro-hexahydropyrimidin-1-ium-5-yl]methanol CAS Name: [(5S)-5-nitro-1,3-di(propan-2-yl)-1,3-diazinan-1-ium-5-yl]methanol IUPAC Name: [(5S)-5-nitro-1,3-di(propan-2-yl)-1,3-diazinan-1-ium-5-yl]methanol Traditional Name: [(5S)-1,3-diisopropyl-5-nitro-hexahydropyrimidin-1-ium-5-yl]methanol Formula: C11H24N3O3+ MolecularWeight: 246.32656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H23N3O3/c1-9(2)12-5-11(7-15,14(16)17)6-13(8-12)10(3)4/h9-10,15H,5-8H2,1-4H3/p+1