bis(phenylmethyl) 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate

Systemtic Name: bis(phenylmethyl) 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate Openeye Name: dibenzyl 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate CAS Name: 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate Traditional Name: 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylic acid dibenzyl ester Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNCCN(CCN1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCNCCN(CCN1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H32N4O4/c29-23(31-19-21-7-3-1-4-8-21)27-15-11-25-13-17-28(18-14-26-12-16-27)24(30)32-20-22-9-5-2-6-10-22/h1-10,25-26H,11-20H2