(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C17H16FNO4S MolecularWeight: 349.376643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

InChI

InChI=1S/C17H16FNO4S/c1-9-11(10(2)23-19-9)8-22-17(20)16-12(7-21-3)15-13(18)5-4-6-14(15)24-16/h4-6H,7-8H2,1-3H3