1,3-ditert-butyl-5-nitro-5-phenyl-1,3-diazinane

Systemtic Name: 1,3-ditert-butyl-5-nitro-5-phenyl-1,3-diazinane Openeye Name: 1,3-ditert-butyl-5-nitro-5-phenyl-hexahydropyrimidine CAS Name: 1,3-ditert-butyl-5-nitro-5-phenyl-1,3-diazinane IUPAC Name: 1,3-ditert-butyl-5-nitro-5-phenyl-1,3-diazinane Traditional Name: 1,3-ditert-butyl-5-nitro-5-phenyl-hexahydropyrimidine Formula: C18H29N3O2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(CN(C1)C(C)(C)C)(C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1CC(CN(C1)C(C)(C)C)(C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H29N3O2/c1-16(2,3)19-12-18(21(22)23,15-10-8-7-9-11-15)13-20(14-19)17(4,5)6/h7-11H,12-14H2,1-6H3