4-[(6-fluoranylquinolin-1-ium-4-yl)amino]benzamide

Systemtic Name: 4-[(6-fluoranylquinolin-1-ium-4-yl)amino]benzamide Openeye Name: 4-[(6-fluoroquinolin-1-ium-4-yl)amino]benzamide CAS Name: 4-[(6-fluoro-4-quinolin-1-iumyl)amino]benzamide IUPAC Name: 4-[(6-fluoroquinolin-1-ium-4-yl)amino]benzamide Traditional Name: 4-[(6-fluoroquinolin-1-ium-4-yl)amino]benzamide Formula: C16H13FN3O+ MolecularWeight: 282.292323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NC2=C3C=C(C=CC3=[NH+]C=C2)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)NC2=C3C=C(C=CC3=[NH+]C=C2)F

InChI

InChI=1S/C16H12FN3O/c17-11-3-6-14-13(9-11)15(7-8-19-14)20-12-4-1-10(2-5-12)16(18)21/h1-9H,(H2,18,21)(H,19,20)/p+1