[2-[2-(2-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-[2-(2-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C17H15FN2O5 MolecularWeight: 346.309803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15FN2O5/c18-15-7-2-1-4-12(15)8-9-19-16(21)11-25-17(22)13-5-3-6-14(10-13)20(23)24/h1-7,10H,8-9,11H2,(H,19,21)