6-ethynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-ethynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-ethynyl-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-ethynyl-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-ethynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-ethynyl-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C13H9F3O3 MolecularWeight: 270.20397

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)OC(C(C2)C(=O)O)C(F)(F)F

Isomeric SMILES

C#CC1=CC2=C(C=C1)OC(C(C2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H9F3O3/c1-2-7-3-4-10-8(5-7)6-9(12(17)18)11(19-10)13(14,15)16/h1,3-5,9,11H,6H2,(H,17,18)