1-[[4-(1,5-diazocan-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane

Systemtic Name: 1-[[4-(1,5-diazocan-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane Openeye Name: 1-[[4-(1,5-diazocan-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane CAS Name: 1-[[4-(1,5-diazocan-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane IUPAC Name: 1-[[4-(1,5-diazocan-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane Traditional Name: 1-[4-(1,5-diazocan-1-ylmethyl)benzyl]-1,4,8,11-tetrazacyclotetradecane Formula: C24H44N6 MolecularWeight: 416.64636

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCC3

Isomeric SMILES

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCC3

InChI

InChI=1S/C24H44N6/c1-9-26-14-15-27-13-4-19-30(20-16-28-10-1)22-24-7-5-23(6-8-24)21-29-17-2-11-25-12-3-18-29/h5-8,25-28H,1-4,9-22H2