1-[2-(2,4,6-trimethylphenyl)ethyl]-1,4,7,10-tetrazacyclododecane

Systemtic Name: 1-[2-(2,4,6-trimethylphenyl)ethyl]-1,4,7,10-tetrazacyclododecane Openeye Name: 1-[2-(2,4,6-trimethylphenyl)ethyl]-1,4,7,10-tetrazacyclododecane CAS Name: 1-[2-(2,4,6-trimethylphenyl)ethyl]-1,4,7,10-tetrazacyclododecane IUPAC Name: 1-[2-(2,4,6-trimethylphenyl)ethyl]-1,4,7,10-tetrazacyclododecane Traditional Name: 1-(2-mesitylethyl)-1,4,7,10-tetrazacyclododecane Formula: C19H34N4 MolecularWeight: 318.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CCN2CCNCCNCCNCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CCN2CCNCCNCCNCC2)C

InChI

InChI=1S/C19H34N4/c1-16-14-17(2)19(18(3)15-16)4-11-23-12-9-21-7-5-20-6-8-22-10-13-23/h14-15,20-22H,4-13H2,1-3H3