ethyl 4-(1,3-benzodioxol-4-yl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanoate

Systemtic Name: ethyl 4-(1,3-benzodioxol-4-yl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanoate Openeye Name: ethyl 4-(1,3-benzodioxol-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanoate CAS Name: 4-(1,3-benzodioxol-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanoate Traditional Name: 4-(1,3-benzodioxol-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)valeric acid ethyl ester Formula: C16H19F3O5 MolecularWeight: 348.31427

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)(C)C1=C2C(=CC=C1)OCO2)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)C(CC(C)(C)C1=C2C(=CC=C1)OCO2)(C(F)(F)F)O

InChI

InChI=1S/C16H19F3O5/c1-4-22-13(20)15(21,16(17,18)19)8-14(2,3)10-6-5-7-11-12(10)24-9-23-11/h5-7,21H,4,8-9H2,1-3H3