(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(trifluoromethyl)benzoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(trifluoromethyl)benzoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H12ClF3O4 MolecularWeight: 372.72299

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H12ClF3O4/c18-13-7-10(8-14-15(13)24-6-5-23-14)9-25-16(22)11-1-3-12(4-2-11)17(19,20)21/h1-4,7-8H,5-6,9H2