N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]benzofuran-2-carboxamide CAS Name: N-[(2S)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-benzofurancarboxamide IUPAC Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]coumarilamide Formula: C21H22FN2O3+ MolecularWeight: 369.409383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC3=CC=CC=C3O2)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=CC3=CC=CC=C3O2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN2O3/c22-17-7-5-15(6-8-17)18(24-9-11-26-12-10-24)14-23-21(25)20-13-16-3-1-2-4-19(16)27-20/h1-8,13,18H,9-12,14H2,(H,23,25)/p+1/t18-/m1/s1