[2-(2-fluorophenyl)-2-oxidanylidene-ethyl] 4-(cyclopropylamino)-3-nitro-benzoate

Systemtic Name: [2-(2-fluorophenyl)-2-oxidanylidene-ethyl] 4-(cyclopropylamino)-3-nitro-benzoate Openeye Name: [2-(2-fluorophenyl)-2-oxo-ethyl] 4-(cyclopropylamino)-3-nitro-benzoate CAS Name: 4-(cyclopropylamino)-3-nitrobenzoic acid [2-(2-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-fluorophenyl)-2-oxoethyl] 4-(cyclopropylamino)-3-nitrobenzoate Traditional Name: 4-(cyclopropylamino)-3-nitro-benzoic acid [2-(2-fluorophenyl)-2-keto-ethyl] ester Formula: C18H15FN2O5 MolecularWeight: 358.320503

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN2O5/c19-14-4-2-1-3-13(14)17(22)10-26-18(23)11-5-8-15(20-12-6-7-12)16(9-11)21(24)25/h1-5,8-9,12,20H,6-7,10H2