2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 2-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [2-[4-(3-fluorobenzyl)piperazino]pyridin-1-ium-3-yl]amine Formula: C16H20FN4+ MolecularWeight: 287.355203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)F)C3=C(C=CC=[NH+]3)N

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)F)C3=C(C=CC=[NH+]3)N

InChI

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