[6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate

Systemtic Name: [6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Openeye Name: [6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate CAS Name: carbonic acid [6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-chromen-3-yl] hydrogen carbonate Traditional Name: carbonic acid [6-(2-phenylethynyl)-2-(trifluoromethyl)-2H-chromen-3-yl] ester Formula: C19H11F3O4 MolecularWeight: 360.28345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)OC(C(=C3)OC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)OC(C(=C3)OC(=O)O)C(F)(F)F

InChI

InChI=1S/C19H11F3O4/c20-19(21,22)17-16(26-18(23)24)11-14-10-13(8-9-15(14)25-17)7-6-12-4-2-1-3-5-12/h1-5,8-11,17H,(H,23,24)