methyl (2R)-4-methyl-2-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]oxy-pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]oxy-pentanoate Openeye Name: methyl (2R)-4-methyl-2-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxy-pentanoate CAS Name: (2R)-4-methyl-2-[[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]oxy]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxypentanoate Traditional Name: (2R)-2-[2-keto-4-(trifluoromethyl)chromen-7-yl]oxy-4-methyl-valeric acid methyl ester Formula: C17H17F3O5 MolecularWeight: 358.30909

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)OC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)OC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

InChI

InChI=1S/C17H17F3O5/c1-9(2)6-14(16(22)23-3)24-10-4-5-11-12(17(18,19)20)8-15(21)25-13(11)7-10/h4-5,7-9,14H,6H2,1-3H3/t14-/m1/s1