copper (2S)-6-azanyl-2-[[(2S)-2-(2-azanylethanoylamino)-3-imidazol-1-id-4-yl-propanoyl]amino]hexanoate

Systemtic Name: copper (2S)-6-azanyl-2-[[(2S)-2-(2-azanylethanoylamino)-3-imidazol-1-id-4-yl-propanoyl]amino]hexanoate Openeye Name: copper (2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-imidazol-1-id-4-yl-propanoyl]amino]hexanoate CAS Name: copper (2S)-6-amino-2-[[(2S)-2-[(2-amino-1-oxoethyl)amino]-3-(4-imidazol-1-idyl)-1-oxopropyl]amino]hexanoate IUPAC Name: copper (2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-imidazol-1-id-4-ylpropanoyl]amino]hexanoate Traditional Name: cupric (2S)-6-amino-2-[[(2S)-2-(glycylamino)-3-imidazol-1-id-4-yl-propanoyl]amino]hexanoate Formula: C14H22CuN6O4 MolecularWeight: 401.90828

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C[N-]1)CC(C(=O)NC(CCCCN)C(=O)[O-])NC(=O)CN.[Cu+2]

Isomeric SMILES

C1=C(N=C[N-]1)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)[O-])NC(=O)CN.[Cu+2]

InChI

InChI=1S/C14H24N6O4.Cu/c15-4-2-1-3-10(14(23)24)20-13(22)11(19-12(21)6-16)5-9-7-17-8-18-9;/h7-8,10-11H,1-6,15-16H2,(H4,17,18,19,20,21,22,23,24);/q;+2/p-2/t10-,11-;/m0./s1