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

Systemtic Name: 1,4-bis[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane Openeye Name: 1,4-bis[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane CAS Name: 1,4-bis[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane IUPAC Name: 1,4-bis[(4-tert-butylphenyl)methyl]-1,4,7,10-tetrazacyclododecane Traditional Name: 1,4-bis(4-tert-butylbenzyl)-1,4,7,10-tetrazacyclododecane Formula: C30H48N4 MolecularWeight: 464.72892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCNCCNCCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCNCCNCCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C30H48N4/c1-29(2,3)27-11-7-25(8-12-27)23-33-19-17-31-15-16-32-18-20-34(22-21-33)24-26-9-13-28(14-10-26)30(4,5)6/h7-14,31-32H,15-24H2,1-6H3