tricopper; oxidanium; azanide; N-[2-(piperidin-1-id-4-ylcarbonylamino)ethyl]piperidin-1-ide-4-carboxamide; N-[2-(piperidin-1-id-4-ylcarbonylamino)ethyl]-2H-pyridin-1-ide-4-carboxamide

Systemtic Name: tricopper; oxidanium; azanide; N-[2-(piperidin-1-id-4-ylcarbonylamino)ethyl]piperidin-1-ide-4-carboxamide; N-[2-(piperidin-1-id-4-ylcarbonylamino)ethyl]-2H-pyridin-1-ide-4-carboxamide Openeye Name: tricopper; oxonium; azanide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]piperidin-1-ide-4-carboxamide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]-2H-pyridin-1-ide-4-carboxamide CAS Name: tricopper; oxonium; azanide; N-[2-[[oxo(4-piperidin-1-idyl)methyl]amino]ethyl]-4-piperidin-1-idecarboxamide; N-[2-[[oxo(4-piperidin-1-idyl)methyl]amino]ethyl]-2H-pyridin-1-ide-4-carboxamide IUPAC Name: tricopper; oxidanium; azanide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]piperidin-1-ide-4-carboxamide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]-2H-pyridin-1-ide-4-carboxamide Traditional Name: tricupric; oxonium; azanide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]piperidin-1-ide-4-carboxamide; N-[2-(piperidin-1-ide-4-carbonylamino)ethyl]-2H-pyridin-1-ide-4-carboxamide Formula: C28H51Cu3N10O5+ MolecularWeight: 798.40654

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N-]CCC1C(=O)NCCNC(=O)C2CC[N-]CC2.C1C[N-]CCC1C(=O)NCCNC(=O)C2=CC[N-]C=C2.[NH2-].[NH2-].[OH3+].[Cu+2].[Cu+2].[Cu+2]

Isomeric SMILES

C1C[N-]CCC1C(=O)NCCNC(=O)C2CC[N-]CC2.C1C[N-]CCC1C(=O)NCCNC(=O)C2=CC[N-]C=C2.[NH2-].[NH2-].[OH3+].[Cu+2].[Cu+2].[Cu+2]

InChI

InChI=1S/C14H24N4O2.C14H20N4O2.3Cu.2H2N.H2O/c2*19-13(11-1-5-15-6-2-11)17-9-10-18-14(20)12-3-7-16-8-4-12;;;;;;/h11-12H,1-10H2,(H,17,19)(H,18,20);1-2,5,12H,3-4,6-10H2,(H,17,19)(H,18,20);;;;3*1H2/q2*-2;3*+2;2*-1;/p+1