6-morpholin-4-yl-N-[3-(trifluoromethyl)phenyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-morpholin-4-yl-N-[3-(trifluoromethyl)phenyl]pyridin-1-ium-3-carboxamide Openeye Name: 6-morpholino-N-[3-(trifluoromethyl)phenyl]pyridin-1-ium-3-carboxamide CAS Name: 6-(4-morpholinyl)-N-[3-(trifluoromethyl)phenyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-morpholin-4-yl-N-[3-(trifluoromethyl)phenyl]pyridin-1-ium-3-carboxamide Traditional Name: 6-morpholino-N-[3-(trifluoromethyl)phenyl]pyridin-1-ium-3-carboxamide Formula: C17H17F3N3O2+ MolecularWeight: 352.33099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H16F3N3O2/c18-17(19,20)13-2-1-3-14(10-13)22-16(24)12-4-5-15(21-11-12)23-6-8-25-9-7-23/h1-5,10-11H,6-9H2,(H,22,24)/p+1