2-fluoranyl-6-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]benzonitrile Formula: C22H21FN3+ MolecularWeight: 346.420643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C22H20FN3/c23-21-9-4-10-22(20(21)15-24)26-13-11-25(12-14-26)16-18-7-3-6-17-5-1-2-8-19(17)18/h1-10H,11-14,16H2/p+1