[2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-[2-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C15H13FN2O5S MolecularWeight: 352.337523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F

InChI

InChI=1S/C15H13FN2O5S/c16-11-3-1-10(2-4-11)7-8-17-13(19)9-23-15(20)12-5-6-14(24-12)18(21)22/h1-6H,7-9H2,(H,17,19)