[2-oxidanylidene-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] 4-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] 4-bromanylbenzoate Openeye Name: [2-oxo-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-keto-2-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)ethyl] ester Formula: C19H24BrNO3 MolecularWeight: 394.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2C(=O)COC(=O)C3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CC1(CC2CC(C1)(CN2C(=O)COC(=O)C3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C19H24BrNO3/c1-18(2)8-15-9-19(3,11-18)12-21(15)16(22)10-24-17(23)13-4-6-14(20)7-5-13/h4-7,15H,8-12H2,1-3H3