5-fluoranyl-2-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]aniline

Systemtic Name: 5-fluoranyl-2-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]aniline Openeye Name: 5-fluoro-2-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]aniline CAS Name: 5-fluoro-2-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]aniline IUPAC Name: 5-fluoro-2-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]aniline Traditional Name: [5-fluoro-2-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]phenyl]amine Formula: C16H20FN4+ MolecularWeight: 287.355203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=C(C=C(C=C3)F)N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=C(C=C(C=C3)F)N

InChI

InChI=1S/C16H19FN4/c17-14-3-4-16(15(18)10-14)21-8-6-20(7-9-21)12-13-2-1-5-19-11-13/h1-5,10-11H,6-9,12,18H2/p+1