1-[[3,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[[3,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-[(3,4-difluorophenyl)methyl]piperidin-1-ium-4-amine CAS Name: 1-[(3,4-difluorophenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[(3,4-difluorophenyl)methyl]piperidin-1-ium-4-amine Traditional Name: [1-(3,4-difluorobenzyl)piperidin-1-ium-4-yl]amine Formula: C12H17F2N2+ MolecularWeight: 227.273586

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N)CC2=CC(=C(C=C2)F)F

Isomeric SMILES

C1C[NH+](CCC1N)CC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C12H16F2N2/c13-11-2-1-9(7-12(11)14)8-16-5-3-10(15)4-6-16/h1-2,7,10H,3-6,8,15H2/p+1