[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C17H11FN2O5S MolecularWeight: 374.343043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C17H11FN2O5S/c18-13-2-1-3-14-12(13)8-15(26-14)17(22)25-9-16(21)19-10-4-6-11(7-5-10)20(23)24/h1-8H,9H2,(H,19,21)