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1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane

1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane

Systemtic Name:1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane
Openeye Name:1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane
CAS Name:1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane
IUPAC Name:1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane
Traditional Name:1-methyl-2,5,8,11-tetraphenyl-1,4,7,10-tetrazacyclododecane
Formula: C33H38N4
MolecularWeight: 490.68162
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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(NCC(NCC(NCC1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5


Isomeric SMILES

CN1CC(NCC(NCC(NCC1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5


InChI

InChI=1S/C33H38N4/c1-37-25-32(28-18-10-4-11-19-28)35-23-30(26-14-6-2-7-15-26)34-22-31(27-16-8-3-9-17-27)36-24-33(37)29-20-12-5-13-21-29/h2-21,30-36H,22-25H2,1H3


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