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

Systemtic Name: 1,7-bis(phenylmethyl)-1,4,7,10-tetrazacyclododecane Openeye Name: 1,7-dibenzyl-1,4,7,10-tetrazacyclododecane CAS Name: 1,7-bis(phenylmethyl)-1,4,7,10-tetrazacyclododecane IUPAC Name: 1,7-dibenzyl-1,4,7,10-tetrazacyclododecane Traditional Name: 1,7-dibenzyl-1,4,7,10-tetrazacyclododecane Formula: C22H32N4 MolecularWeight: 352.51628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNCCN(CCN1)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCNCCN(CCN1)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H32N4/c1-3-7-21(8-4-1)19-25-15-11-23-13-17-26(18-14-24-12-16-25)20-22-9-5-2-6-10-22/h1-10,23-24H,11-20H2