2-[(6-fluoranylquinolin-1-ium-4-yl)amino]benzenecarbonitrile

Systemtic Name: 2-[(6-fluoranylquinolin-1-ium-4-yl)amino]benzenecarbonitrile Openeye Name: 2-[(6-fluoroquinolin-1-ium-4-yl)amino]benzonitrile CAS Name: 2-[(6-fluoro-4-quinolin-1-iumyl)amino]benzonitrile IUPAC Name: 2-[(6-fluoroquinolin-1-ium-4-yl)amino]benzonitrile Traditional Name: 2-[(6-fluoroquinolin-1-ium-4-yl)amino]benzonitrile Formula: C16H11FN3+ MolecularWeight: 264.277043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10FN3/c17-12-5-6-15-13(9-12)16(7-8-19-15)20-14-4-2-1-3-11(14)10-18/h1-9H,(H,19,20)/p+1