copper (2S)-2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: copper (2S)-2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate Openeye Name: copper (2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate CAS Name: copper (2S)-2-[(3-amino-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: copper (2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate Traditional Name: cupric (2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propionate Formula: C18H26CuN8O6 MolecularWeight: 513.99504

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)[O-])NC(=O)CCN.C1=C(NC=N1)CC(C(=O)[O-])NC(=O)CCN.[Cu+2]

Isomeric SMILES

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

InChI

InChI=1S/2C9H14N4O3.Cu/c2*10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6;/h2*4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16);/q;;+2/p-2/t2*7-;/m00./s1