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3-(1-oxidanylideneisochromen-3-yl)propyl 2-(trifluoromethyl)benzoate

3-(1-oxidanylideneisochromen-3-yl)propyl 2-(trifluoromethyl)benzoate

Systemtic Name:3-(1-oxidanylideneisochromen-3-yl)propyl 2-(trifluoromethyl)benzoate
Openeye Name:3-(1-oxoisochromen-3-yl)propyl 2-(trifluoromethyl)benzoate
CAS Name:2-(trifluoromethyl)benzoic acid 3-(1-oxo-2-benzopyran-3-yl)propyl ester
IUPAC Name:3-(1-oxoisochromen-3-yl)propyl 2-(trifluoromethyl)benzoate
Traditional Name:2-(trifluoromethyl)benzoic acid 3-(1-ketoisochromen-3-yl)propyl ester
Formula: C20H15F3O4
MolecularWeight: 376.32591
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)CCCOC(=O)C3=CC=CC=C3C(F)(F)F


Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)CCCOC(=O)C3=CC=CC=C3C(F)(F)F


InChI

InChI=1S/C20H15F3O4/c21-20(22,23)17-10-4-3-9-16(17)18(24)26-11-5-7-14-12-13-6-1-2-8-15(13)19(25)27-14/h1-4,6,8-10,12H,5,7,11H2


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