4-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 4-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane Openeye Name: 4-benzylquinuclidin-1-ium CAS Name: 4-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane IUPAC Name: 4-benzyl-1-azoniabicyclo[2.2.2]octane Traditional Name: 4-benzylquinuclidin-1-ium Formula: C14H20N+ MolecularWeight: 202.3153

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1(CC2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+]2CCC1(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C14H19N/c1-2-4-13(5-3-1)12-14-6-9-15(10-7-14)11-8-14/h1-5H,6-12H2/p+1