1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-carbonitrile Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]piperidin-1-ium-4-carbonitrile CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]piperidin-1-ium-4-carbonitrile Traditional Name: 1-(2-chloro-6-fluoro-benzyl)piperidin-1-ium-4-carbonitrile Formula: C13H15ClFN2+ MolecularWeight: 253.723003

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C#N)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1C[NH+](CCC1C#N)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H14ClFN2/c14-12-2-1-3-13(15)11(12)9-17-6-4-10(8-16)5-7-17/h1-3,10H,4-7,9H2/p+1