3-fluoranyl-4-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]benzonitrile CAS Name: 3-fluoro-4-[[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]benzonitrile Traditional Name: 3-fluoro-4-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]benzonitrile Formula: C21H21FN3+ MolecularWeight: 334.409943

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC4=C(C=C(C=C4)C#N)F

Isomeric SMILES

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C21H20FN3/c22-20-11-15(12-23)5-6-17(20)14-25-9-7-16(8-10-25)19-13-24-21-4-2-1-3-18(19)21/h1-6,11,13,16,24H,7-10,14H2/p+1