1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl 2H-chromene-3-carboxylate

Systemtic Name: 1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl 2H-chromene-3-carboxylate Openeye Name: 1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl 2H-chromene-3-carboxylate CAS Name: 2H-1-benzopyran-3-carboxylic acid 1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl 2H-chromene-3-carboxylate Traditional Name: 2H-chromene-3-carboxylic acid 1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C21H15F3N2O4 MolecularWeight: 416.35001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CC(=CC=C2)C(F)(F)F)OC(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

CC(C1=NC(=NO1)C2=CC(=CC=C2)C(F)(F)F)OC(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C21H15F3N2O4/c1-12(29-20(27)15-9-13-5-2-3-8-17(13)28-11-15)19-25-18(26-30-19)14-6-4-7-16(10-14)21(22,23)24/h2-10,12H,11H2,1H3