[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: 3-[3-(trifluoromethyl)phenyl]-2-propenoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: 3-[3-(trifluoromethyl)phenyl]acrylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C21H20F3NO3 MolecularWeight: 391.38361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C=CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C=CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C21H20F3NO3/c22-21(23,24)18-10-4-8-17(14-18)11-12-20(27)28-15-19(26)25-13-5-9-16-6-2-1-3-7-16/h1-4,6-8,10-12,14H,5,9,13,15H2,(H,25,26)