(2S)-2-azanyl-5-[[2-nitrooxy-1-(2-oxidanylidenepropanoyloxy)ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[[2-nitrooxy-1-(2-oxidanylidenepropanoyloxy)ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[[2-nitrooxy-1-(2-oxopropanoyloxy)ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[[1-(1,2-dioxopropoxy)-2-nitrooxyethyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[[2-nitrooxy-1-(2-oxopropanoyloxy)ethyl]amino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[(2-nitrooxy-1-pyruvoyloxy-ethyl)amino]valeric acid Formula: C10H15N3O9 MolecularWeight: 321.2408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)OC(CO[N+](=O)[O-])NC(=O)CCC(C(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C10H15N3O9/c1-5(14)10(18)22-8(4-21-13(19)20)12-7(15)3-2-6(11)9(16)17/h6,8H,2-4,11H2,1H3,(H,12,15)(H,16,17)/t6-,8?/m0/s1