1-[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane Openeye Name: 1-[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane CAS Name: 1-[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane Traditional Name: 1-(4-tert-butylbenzyl)-1,4,7,10-tetrazacyclododecane Formula: C19H34N4 MolecularWeight: 318.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCNCCNCCNCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCNCCNCCNCC2

InChI

InChI=1S/C19H34N4/c1-19(2,3)18-6-4-17(5-7-18)16-23-14-12-21-10-8-20-9-11-22-13-15-23/h4-7,20-22H,8-16H2,1-3H3