(2S)-2-azanyl-5-(4-nitrooxybut-2-ynoxy)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-(4-nitrooxybut-2-ynoxy)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-(4-nitrooxybut-2-ynoxy)-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-(4-nitrooxybut-2-ynoxy)-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-(4-nitrooxybut-2-ynoxy)-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-(4-nitrooxybut-2-ynoxy)valeric acid Formula: C9H12N2O7 MolecularWeight: 260.20078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O7/c10-7(9(13)14)3-4-8(12)17-5-1-2-6-18-11(15)16/h7H,3-6,10H2,(H,13,14)/t7-/m0/s1