1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]-1,3-diazinane

Systemtic Name: 1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]-1,3-diazinane Openeye Name: 1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]hexahydropyrimidine CAS Name: 1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]-1,3-diazinane IUPAC Name: 1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]-1,3-diazinane Traditional Name: 1,3-dimethyl-5-nitro-5-[(4-nitrophenoxy)methyl]hexahydropyrimidine Formula: C13H18N4O5 MolecularWeight: 310.30582

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CN(C1)C)(COC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CC(CN(C1)C)(COC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O5/c1-14-7-13(17(20)21,8-15(2)10-14)9-22-12-5-3-11(4-6-12)16(18)19/h3-6H,7-10H2,1-2H3