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

Systemtic Name: 6-(4-chlorophenyl)carbonyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-(4-chlorobenzoyl)-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-[(4-chlorophenyl)-oxomethyl]-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-(4-chlorobenzoyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-(4-chlorobenzoyl)-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C18H12ClF3O4 MolecularWeight: 384.73369

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C1C=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C1C=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H12ClF3O4/c19-12-4-1-9(2-5-12)15(23)10-3-6-14-11(7-10)8-13(17(24)25)16(26-14)18(20,21)22/h1-7,13,16H,8H2,(H,24,25)