2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+)

Systemtic Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+) Openeye Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+) CAS Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+) IUPAC Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+) Traditional Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate; yttrium(3+) Formula: C12H19N4O6Y MolecularWeight: 404.20831

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN(CCNCCN1C(=O)[O-])C(=O)[O-])C(=O)[O-].[Y+3]

Isomeric SMILES

CC1CN(CCN(CCNCCN1C(=O)[O-])C(=O)[O-])C(=O)[O-].[Y+3]

InChI

InChI=1S/C12H22N4O6.Y/c1-9-8-15(11(19)20)7-6-14(10(17)18)4-2-13-3-5-16(9)12(21)22;/h9,13H,2-8H2,1H3,(H,17,18)(H,19,20)(H,21,22);/q;+3/p-3