1,4,8,11-tetrakis(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane

Systemtic Name: 1,4,8,11-tetrakis(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane Openeye Name: 1,4,8,11-tetrakis(2-pyridylmethyl)-1,4,8,11-tetrazacyclotetradecane CAS Name: 1,4,8,11-tetrakis(2-pyridinylmethyl)-1,4,8,11-tetrazacyclotetradecane IUPAC Name: 1,4,8,11-tetrakis(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane Traditional Name: 1,4,8,11-tetrakis(2-pyridylmethyl)-1,4,8,11-tetrazacyclotetradecane Formula: C34H44N8 MolecularWeight: 564.76676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCCN(CCN(C1)CC2=CC=CC=N2)CC3=CC=CC=N3)CC4=CC=CC=N4)CC5=CC=CC=N5

Isomeric SMILES

C1CN(CCN(CCCN(CCN(C1)CC2=CC=CC=N2)CC3=CC=CC=N3)CC4=CC=CC=N4)CC5=CC=CC=N5

InChI

InChI=1S/C34H44N8/c1-5-15-35-31(11-1)27-39-19-9-20-41(29-33-13-3-7-17-37-33)25-26-42(30-34-14-4-8-18-38-34)22-10-21-40(24-23-39)28-32-12-2-6-16-36-32/h1-8,11-18H,9-10,19-30H2