ethyl 4-fluoranyl-3-[(5-fluoranyl-2-nitro-phenoxy)methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[(5-fluoranyl-2-nitro-phenoxy)methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(5-fluoro-2-nitro-phenoxy)methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(5-fluoro-2-nitrophenoxy)methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(5-fluoro-2-nitrophenoxy)methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(5-fluoro-2-nitro-phenoxy)methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C18H13F2NO5S MolecularWeight: 393.361326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H13F2NO5S/c1-2-25-18(22)17-11(16-12(20)4-3-5-15(16)27-17)9-26-14-8-10(19)6-7-13(14)21(23)24/h3-8H,2,9H2,1H3