(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[3-(trifluoromethyl)phenyl]ethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[3-(trifluoromethyl)phenyl]ethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-[3-(trifluoromethyl)phenyl]acetate CAS Name: 2-[3-(trifluoromethyl)phenyl]acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-[3-(trifluoromethyl)phenyl]acetate Traditional Name: 2-[3-(trifluoromethyl)phenyl]acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H17F3O4 MolecularWeight: 390.35249

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CC3=CC(=CC=C3)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CC3=CC(=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C21H17F3O4/c1-12-6-17-15(10-20(26)28-18(17)7-13(12)2)11-27-19(25)9-14-4-3-5-16(8-14)21(22,23)24/h3-8,10H,9,11H2,1-2H3