[2-(dimethylamino)pyridin-1-ium-3-yl]methyl-[(6-fluoranylquinolin-2-yl)methyl]azanium

Systemtic Name: [2-(dimethylamino)pyridin-1-ium-3-yl]methyl-[(6-fluoranylquinolin-2-yl)methyl]azanium Openeye Name: [2-(dimethylamino)pyridin-1-ium-3-yl]methyl-[(6-fluoro-2-quinolyl)methyl]ammonium CAS Name: [2-(dimethylamino)-3-pyridin-1-iumyl]methyl-[(6-fluoro-2-quinolinyl)methyl]ammonium IUPAC Name: [2-(dimethylamino)pyridin-1-ium-3-yl]methyl-[(6-fluoroquinolin-2-yl)methyl]azanium Traditional Name: [2-(dimethylamino)pyridin-1-ium-3-yl]methyl-[(6-fluoro-2-quinolyl)methyl]ammonium Formula: C18H21FN4+2 MolecularWeight: 312.384543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=[NH+]1)C[NH2+]CC2=NC3=C(C=C2)C=C(C=C3)F

Isomeric SMILES

CN(C)C1=C(C=CC=[NH+]1)C[NH2+]CC2=NC3=C(C=C2)C=C(C=C3)F

InChI

InChI=1S/C18H19FN4/c1-23(2)18-14(4-3-9-21-18)11-20-12-16-7-5-13-10-15(19)6-8-17(13)22-16/h3-10,20H,11-12H2,1-2H3/p+2