(2-chloranyl-6-fluoranyl-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C13H20ClFN2+2 MolecularWeight: 258.762703

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C[NH2+]CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1C[NH2+]CCC1C[NH2+]CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H18ClFN2/c14-12-2-1-3-13(15)11(12)9-17-8-10-4-6-16-7-5-10/h1-3,10,16-17H,4-9H2/p+2