5,6-dinitrooxyhexyl 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoate

Systemtic Name: 5,6-dinitrooxyhexyl 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoate Openeye Name: 5,6-dinitrooxyhexyl 2-amino-5-guanidino-pentanoate CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid 5,6-dinitrooxyhexyl ester IUPAC Name: 5,6-dinitrooxyhexyl 2-amino-5-(diaminomethylideneamino)pentanoate Traditional Name: 2-amino-5-guanidino-valeric acid 5,6-dinitrooxyhexyl ester Formula: C12H24N6O8 MolecularWeight: 380.35436

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Descriptors Computed from Structure

Canonical SMILES:

C(CCOC(=O)C(CCCN=C(N)N)N)CC(CO[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

C(CCOC(=O)C(CCCN=C(N)N)N)CC(CO[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C12H24N6O8/c13-10(5-3-6-16-12(14)15)11(19)24-7-2-1-4-9(26-18(22)23)8-25-17(20)21/h9-10H,1-8,13H2,(H4,14,15,16)