(5S)-1,3-ditert-butyl-5-ethyl-5-nitro-1,3-diazinan-1-ium

Systemtic Name: (5S)-1,3-ditert-butyl-5-ethyl-5-nitro-1,3-diazinan-1-ium Openeye Name: (5S)-1,3-ditert-butyl-5-ethyl-5-nitro-hexahydropyrimidin-1-ium CAS Name: (5S)-1,3-ditert-butyl-5-ethyl-5-nitro-1,3-diazinan-1-ium IUPAC Name: (5S)-1,3-ditert-butyl-5-ethyl-5-nitro-1,3-diazinan-1-ium Traditional Name: (5S)-1,3-ditert-butyl-5-ethyl-5-nitro-hexahydropyrimidin-1-ium Formula: C14H30N3O2+ MolecularWeight: 272.4069

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C[NH+](CN(C1)C(C)(C)C)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H29N3O2/c1-8-14(17(18)19)9-15(12(2,3)4)11-16(10-14)13(5,6)7/h8-11H2,1-7H3/p+1