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

Systemtic Name: 7-[4-(2-carboxyethyl)phenoxy]-6-chloranyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 7-[4-(2-carboxyethyl)phenoxy]-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 7-[4-(2-carboxyethyl)phenoxy]-6-chloro-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 7-[4-(2-carboxyethyl)phenoxy]-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 7-[4-(2-carboxyethyl)phenoxy]-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C20H14ClF3O6 MolecularWeight: 442.76977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl

InChI

InChI=1S/C20H14ClF3O6/c21-14-8-11-7-13(19(27)28)18(20(22,23)24)30-15(11)9-16(14)29-12-4-1-10(2-5-12)3-6-17(25)26/h1-2,4-5,7-9,18H,3,6H2,(H,25,26)(H,27,28)