4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 4-[2-(4-chlorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C19H10ClF3O3 MolecularWeight: 378.72911

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(O2)C(F)(F)F)C(=O)O)C#CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(O2)C(F)(F)F)C(=O)O)C#CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H10ClF3O3/c20-12-8-5-11(6-9-12)7-10-14-13-3-1-2-4-15(13)26-17(19(21,22)23)16(14)18(24)25/h1-6,8-9,17H,(H,24,25)