10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid

Systemtic Name: 10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid Openeye Name: 10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid CAS Name: 10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid IUPAC Name: 10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid Traditional Name: 10-methyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylic acid Formula: C12H22N4O6 MolecularWeight: 318.32628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CCN(CCN(CC1)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CCN(CCN(CC1)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C12H22N4O6/c1-13-2-4-14(10(17)18)6-8-16(12(21)22)9-7-15(5-3-13)11(19)20/h2-9H2,1H3,(H,17,18)(H,19,20)(H,21,22)