3,9-bis(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione

Systemtic Name: 3,9-bis(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione Openeye Name: 3,9-dibenzyl-1,4,8,11-tetrazacyclotetradecane-5,7-dione CAS Name: 3,9-bis(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione IUPAC Name: 3,9-dibenzyl-1,4,8,11-tetrazacyclotetradecane-5,7-dione Traditional Name: 3,9-dibenzyl-1,4,8,11-tetrazacyclotetradecane-5,7-quinone Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(NC(=O)CC(=O)NC(CNC1)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CNCC(NC(=O)CC(=O)NC(CNC1)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C24H32N4O2/c29-23-16-24(30)28-22(15-20-10-5-2-6-11-20)18-26-13-7-12-25-17-21(27-23)14-19-8-3-1-4-9-19/h1-6,8-11,21-22,25-26H,7,12-18H2,(H,27,29)(H,28,30)