(3,3-dimethyl-2-oxidanylidene-butyl) 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C15H14ClFO3S MolecularWeight: 328.786263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C(C2=C(S1)C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C(C2=C(S1)C=C(C=C2)F)Cl

InChI

InChI=1S/C15H14ClFO3S/c1-15(2,3)11(18)7-20-14(19)13-12(16)9-5-4-8(17)6-10(9)21-13/h4-6H,7H2,1-3H3