[2-[(4-fluoranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(4-fluoranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(4-fluoro-2-nitro-anilino)-2-oxo-ethyl] 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid [2-(4-fluoro-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoro-2-nitroanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid [2-(4-fluoro-2-nitro-anilino)-2-keto-ethyl] ester Formula: C17H9ClF2N2O5S MolecularWeight: 426.778566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)OCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)OCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H9ClF2N2O5S/c18-15-10-3-1-9(20)6-13(10)28-16(15)17(24)27-7-14(23)21-11-4-2-8(19)5-12(11)22(25)26/h1-6H,7H2,(H,21,23)