(3-fluoranyl-4-methoxy-phenyl)methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C17H11ClF2O3S MolecularWeight: 368.782246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)F

InChI

InChI=1S/C17H11ClF2O3S/c1-22-13-5-2-9(6-12(13)20)8-23-17(21)16-15(18)11-4-3-10(19)7-14(11)24-16/h2-7H,8H2,1H3