[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(trifluoromethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(trifluoromethyl)benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C13H10F3NO3 MolecularWeight: 285.21861

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3/c1-2-6-17-11(18)8-20-12(19)9-4-3-5-10(7-9)13(14,15)16/h1,3-5,7H,6,8H2,(H,17,18)