copper 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]ethanoic acid

Systemtic Name: copper 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]ethanoic acid Openeye Name: copper 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid CAS Name: copper 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid IUPAC Name: copper 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid Traditional Name: cupric 2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid Formula: C12H21CuN3O6+2 MolecularWeight: 366.85764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O.[Cu+2]

Isomeric SMILES

C1CN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O.[Cu+2]

InChI

InChI=1S/C12H21N3O6.Cu/c16-10(17)7-13-1-2-14(8-11(18)19)5-6-15(4-3-13)9-12(20)21;/h1-9H2,(H,16,17)(H,18,19)(H,20,21);/q;+2