[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]peroxy (2S)-2-azanyl-3-(1H-imidazol-5-yl)propaneperoxoate

Systemtic Name: [(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]peroxy (2S)-2-azanyl-3-(1H-imidazol-5-yl)propaneperoxoate Openeye Name: [(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]peroxy (2S)-2-amino-3-(1H-imidazol-5-yl)propaneperoxoate CAS Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propaneperoxoic acid [(2S)-2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]dioxy ester IUPAC Name: [(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]peroxy (2S)-2-amino-3-(1H-imidazol-5-yl)propaneperoxoate Traditional Name: (2S)-2-amino-3-(1H-imidazol-5-yl)peroxypropionic acid [(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]peroxy ester Formula: C12H16N6O6 MolecularWeight: 340.29204

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)OOOOC(=O)C(CC2=CN=CN2)N)N

Isomeric SMILES

C1=C(NC=N1)C[C@@H](C(=O)OOOOC(=O)[C@H](CC2=CN=CN2)N)N

InChI

InChI=1S/C12H16N6O6/c13-9(1-7-3-15-5-17-7)11(19)21-23-24-22-12(20)10(14)2-8-4-16-6-18-8/h3-6,9-10H,1-2,13-14H2,(H,15,17)(H,16,18)/t9-,10-/m0/s1