(2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) 2,4,6-trimethylbenzoate

Systemtic Name: (2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) 2,4,6-trimethylbenzoate Openeye Name: (2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid (2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) ester IUPAC Name: (2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-yl) ester Formula: C20H29NO2 MolecularWeight: 315.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC2CC3(CCC2C(N3)(C)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC2CC3(CCC2C(N3)(C)C)C)C

InChI

InChI=1S/C20H29NO2/c1-12-9-13(2)17(14(3)10-12)18(22)23-16-11-20(6)8-7-15(16)19(4,5)21-20/h9-10,15-16,21H,7-8,11H2,1-6H3