N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-6-morpholin-4-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-6-morpholin-4-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-6-morpholino-pyridin-1-ium-3-carboxamide CAS Name: N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-6-(4-morpholinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-6-morpholin-4-ylpyridin-1-ium-3-carboxamide Traditional Name: N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-6-morpholino-pyridin-1-ium-3-carboxamide Formula: C19H21FN3O4+ MolecularWeight: 374.386143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)C(=O)NCC3=C4C(=CC(=C3)F)COCO4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)C(=O)NCC3=C4C(=CC(=C3)F)COCO4

InChI

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