ethyl 2-(1-benzothiophen-5-ylmethyl)-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(1-benzothiophen-5-ylmethyl)-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(benzothiophen-5-ylmethyl)-4,4,4-trifluoro-3-oxo-butanoate CAS Name: 2-(1-benzothiophen-5-ylmethyl)-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(1-benzothiophen-5-ylmethyl)-4,4,4-trifluoro-3-oxobutanoate Traditional Name: 2-(benzothiophen-5-ylmethyl)-4,4,4-trifluoro-3-keto-butyric acid ethyl ester Formula: C15H13F3O3S MolecularWeight: 330.32213

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)SC=C2)C(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)SC=C2)C(=O)C(F)(F)F

InChI

InChI=1S/C15H13F3O3S/c1-2-21-14(20)11(13(19)15(16,17)18)8-9-3-4-12-10(7-9)5-6-22-12/h3-7,11H,2,8H2,1H3