6-chloranyl-7-[4-(hydroxymethyl)phenoxy]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-7-[4-(hydroxymethyl)phenoxy]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-7-[4-(hydroxymethyl)phenoxy]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 6-chloro-7-[4-(hydroxymethyl)phenoxy]-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-7-[4-(hydroxymethyl)phenoxy]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-7-(4-methylolphenoxy)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C18H12ClF3O5 MolecularWeight: 400.73309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CO)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CO)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl

InChI

InChI=1S/C18H12ClF3O5/c19-13-6-10-5-12(17(24)25)16(18(20,21)22)27-14(10)7-15(13)26-11-3-1-9(8-23)2-4-11/h1-7,16,23H,8H2,(H,24,25)