(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,5-bis(trifluoromethyl)benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,5-bis(trifluoromethyl)benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3,5-bis(trifluoromethyl)benzoate CAS Name: 3,5-bis(trifluoromethyl)benzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 3,5-bis(trifluoromethyl)benzoate Traditional Name: 3,5-bis(trifluoromethyl)benzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C23H18F6O4 MolecularWeight: 472.377039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(C)C

InChI

InChI=1S/C23H18F6O4/c1-11(2)17-9-18-14(7-20(30)33-19(18)4-12(17)3)10-32-21(31)13-5-15(22(24,25)26)8-16(6-13)23(27,28)29/h4-9,11H,10H2,1-3H3