[2-oxidanylidene-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] 2-(4-cyanophenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] 2-(4-cyanophenoxy)ethanoate Openeye Name: [2-oxo-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid [2-oxo-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] ester IUPAC Name: [2-oxo-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid [2-keto-2-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]ethyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2C(=O)COC(=O)COC3=CC=C(C=C3)C#N)C)C

Isomeric SMILES

C[C@@]12C[C@@H](CC(C1)(C)C)N(C2)C(=O)COC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H26N2O4/c1-20(2)8-16-9-21(3,13-20)14-23(16)18(24)11-27-19(25)12-26-17-6-4-15(10-22)5-7-17/h4-7,16H,8-9,11-14H2,1-3H3/t16-,21-/m1/s1