(2S)-2-azanyl-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]valeric acid Formula: C10H16N4O13 MolecularWeight: 400.25304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C(CC(=O)OCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])[C@@H](C(=O)O)N

InChI

InChI=1S/C10H16N4O13/c11-7(9(16)17)1-2-8(15)24-3-10(4-25-12(18)19,5-26-13(20)21)6-27-14(22)23/h7H,1-6,11H2,(H,16,17)/t7-/m0/s1