2-[[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(2R)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]iminomethyl]-4-nitro-phenolate Formula: C19H20FN3O4 MolecularWeight: 373.378203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=C(C=C3)F

Isomeric SMILES

C1COCC[NH+]1[C@@H](CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN3O4/c20-16-3-1-14(2-4-16)18(22-7-9-27-10-8-22)13-21-12-15-11-17(23(25)26)5-6-19(15)24/h1-6,11-12,18,24H,7-10,13H2/t18-/m0/s1