6-chloranyl-8-(phenylmethoxymethyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-8-(phenylmethoxymethyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 8-(benzyloxymethyl)-6-chloro-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-chloro-8-(phenylmethoxymethyl)-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-8-(phenylmethoxymethyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 8-(benzoxymethyl)-6-chloro-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C19H16ClF3O4 MolecularWeight: 400.77615

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C(C=C(C=C21)Cl)COCC3=CC=CC=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C(C=C(C=C21)Cl)COCC3=CC=CC=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C19H16ClF3O4/c20-14-6-12-8-15(18(24)25)17(19(21,22)23)27-16(12)13(7-14)10-26-9-11-4-2-1-3-5-11/h1-7,15,17H,8-10H2,(H,24,25)