2-[5-(carboxymethyl)-1,5-diazocan-1-yl]ethanoic acid; nickel(2+); hydrate

Systemtic Name: 2-[5-(carboxymethyl)-1,5-diazocan-1-yl]ethanoic acid; nickel(2+); hydrate Openeye Name: nickelous 2-[5-(carboxymethyl)-1,5-diazocan-1-yl]acetic acid hydrate CAS Name: 2-[5-(carboxymethyl)-1,5-diazocan-1-yl]acetic acid; nickel(2+); hydrate IUPAC Name: 2-[5-(carboxymethyl)-1,5-diazocan-1-yl]acetic acid; nickel(2+); hydrate Traditional Name: nickelous 2-[5-(carboxymethyl)-1,5-diazocan-1-yl]acetic acid hydrate Formula: C10H20N2NiO5+2 MolecularWeight: 306.9696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCCN(C1)CC(=O)O)CC(=O)O.O.[Ni+2]

Isomeric SMILES

C1CN(CCCN(C1)CC(=O)O)CC(=O)O.O.[Ni+2]

InChI

InChI=1S/C10H18N2O4.Ni.H2O/c13-9(14)7-11-3-1-4-12(6-2-5-11)8-10(15)16;;/h1-8H2,(H,13,14)(H,15,16);;1H2/q;+2;