[(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 3-(trifluoromethyl)benzoate

Systemtic Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 3-(trifluoromethyl)benzoate Openeye Name: [(1R)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [(2R)-1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [(1R)-2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C21H16F3NO3 MolecularWeight: 387.35185

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H16F3NO3/c1-13(28-20(27)15-8-4-9-16(12-15)21(22,23)24)19(26)25-18-11-5-7-14-6-2-3-10-17(14)18/h2-13H,1H3,(H,25,26)/t13-/m1/s1