2-oxidanylidene-7-[[4-(trifluoromethyl)phenyl]methoxy]-3,4-dihydrochromene-3-carboxylic acid

Systemtic Name: 2-oxidanylidene-7-[[4-(trifluoromethyl)phenyl]methoxy]-3,4-dihydrochromene-3-carboxylic acid Openeye Name: 2-oxo-7-[[4-(trifluoromethyl)phenyl]methoxy]chromane-3-carboxylic acid CAS Name: 2-oxo-7-[[4-(trifluoromethyl)phenyl]methoxy]-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-oxo-7-[[4-(trifluoromethyl)phenyl]methoxy]-3,4-dihydrochromene-3-carboxylic acid Traditional Name: 2-keto-7-[4-(trifluoromethyl)benzyl]oxy-chroman-3-carboxylic acid Formula: C18H13F3O5 MolecularWeight: 366.28803

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H13F3O5/c19-18(20,21)12-4-1-10(2-5-12)9-25-13-6-3-11-7-14(16(22)23)17(24)26-15(11)8-13/h1-6,8,14H,7,9H2,(H,22,23)