[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl] 3-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl] 3-bromanylbenzoate Openeye Name: [2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-keto-2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl] ester Formula: C20H18BrF3N2O3 MolecularWeight: 471.26773

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)COC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)COC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrF3N2O3/c21-16-5-1-3-14(11-16)19(28)29-13-18(27)26-9-7-25(8-10-26)17-6-2-4-15(12-17)20(22,23)24/h1-6,11-12H,7-10,13H2