1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-1,3-diazinane

Systemtic Name: 1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-1,3-diazinane Openeye Name: 1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-hexahydropyrimidine CAS Name: 1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-1,3-diazinane IUPAC Name: 1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-1,3-diazinane Traditional Name: 1,3-bis(2-ethylhexyl)-5-methyl-5-nitro-hexahydropyrimidine Formula: C21H43N3O2 MolecularWeight: 369.58502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)[N+](=O)[O-]

Isomeric SMILES

CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)[N+](=O)[O-]

InChI

InChI=1S/C21H43N3O2/c1-6-10-12-19(8-3)14-22-16-21(5,24(25)26)17-23(18-22)15-20(9-4)13-11-7-2/h19-20H,6-18H2,1-5H3