2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid

Systemtic Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid Openeye Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid CAS Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid IUPAC Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid Traditional Name: 2-methyl-1,4,7,10-tetrazacyclododecane-1,4,7,10-tetracarboxylic acid Formula: C13H22N4O8 MolecularWeight: 362.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN(CCN(CCN1C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CC1CN(CCN(CCN(CCN1C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C13H22N4O8/c1-9-8-16(12(22)23)5-4-14(10(18)19)2-3-15(11(20)21)6-7-17(9)13(24)25/h9H,2-8H2,1H3,(H,18,19)(H,20,21)(H,22,23)(H,24,25)