ethyl 4-fluoranyl-3-[(4-nitrophenyl)carbonyloxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[(4-nitrophenyl)carbonyloxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(4-nitrobenzoyl)oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[(4-nitrophenyl)-oxomethoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(4-nitrobenzoyl)oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(4-nitrobenzoyl)oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H14FNO6S MolecularWeight: 403.380963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14FNO6S/c1-2-26-19(23)17-13(16-14(20)4-3-5-15(16)28-17)10-27-18(22)11-6-8-12(9-7-11)21(24)25/h3-9H,2,10H2,1H3