(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoate; nickel(2+)

Systemtic Name: (2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoate; nickel(2+) Openeye Name: nickelous (2S)-2-amino-3-(1H-imidazol-5-yl)propanoate CAS Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoate; nickel(2+) IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoate; nickel(2+) Traditional Name: nickelous (2S)-2-amino-3-(1H-imidazol-5-yl)propionate Formula: C12H16N6NiO4 MolecularWeight: 366.98664

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)[O-])N.C1=C(NC=N1)CC(C(=O)[O-])N.[Ni+2]

Isomeric SMILES

C1=C(NC=N1)C[C@@H](C(=O)[O-])N.C1=C(NC=N1)C[C@@H](C(=O)[O-])N.[Ni+2]

InChI

InChI=1S/2C6H9N3O2.Ni/c2*7-5(6(10)11)1-4-2-8-3-9-4;/h2*2-3,5H,1,7H2,(H,8,9)(H,10,11);/q;;+2/p-2/t2*5-;/m00./s1