2,2,2-tris(fluoranyl)ethyl N-(3-ethynylphenyl)carbamate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl N-(3-ethynylphenyl)carbamate Openeye Name: 2,2,2-trifluoroethyl N-(3-ethynylphenyl)carbamate CAS Name: N-(3-ethynylphenyl)carbamic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl N-(3-ethynylphenyl)carbamate Traditional Name: N-(3-ethynylphenyl)carbamic acid 2,2,2-trifluoroethyl ester Formula: C11H8F3NO2 MolecularWeight: 243.18193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)OCC(F)(F)F

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)OCC(F)(F)F

InChI

InChI=1S/C11H8F3NO2/c1-2-8-4-3-5-9(6-8)15-10(16)17-7-11(12,13)14/h1,3-6H,7H2,(H,15,16)