methyl 5-ethyl-2-oxidanyl-3-(phenylmethyl)-6-(trifluoromethyl)benzoate

Systemtic Name: methyl 5-ethyl-2-oxidanyl-3-(phenylmethyl)-6-(trifluoromethyl)benzoate Openeye Name: methyl 3-benzyl-5-ethyl-2-hydroxy-6-(trifluoromethyl)benzoate CAS Name: 5-ethyl-2-hydroxy-3-(phenylmethyl)-6-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 3-benzyl-5-ethyl-2-hydroxy-6-(trifluoromethyl)benzoate Traditional Name: 3-benzyl-5-ethyl-2-hydroxy-6-(trifluoromethyl)benzoic acid methyl ester Formula: C18H17F3O3 MolecularWeight: 338.32099

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1C(F)(F)F)C(=O)OC)O)CC2=CC=CC=C2

Isomeric SMILES

CCC1=CC(=C(C(=C1C(F)(F)F)C(=O)OC)O)CC2=CC=CC=C2

InChI

InChI=1S/C18H17F3O3/c1-3-12-10-13(9-11-7-5-4-6-8-11)16(22)14(17(23)24-2)15(12)18(19,20)21/h4-8,10,22H,3,9H2,1-2H3