[(1R)-1-pyridin-1-ium-1-ylpropyl] benzoate

Systemtic Name: [(1R)-1-pyridin-1-ium-1-ylpropyl] benzoate Openeye Name: [(1R)-1-pyridin-1-ium-1-ylpropyl] benzoate CAS Name: benzoic acid [(1R)-1-(1-pyridin-1-iumyl)propyl] ester IUPAC Name: [(1R)-1-pyridin-1-ium-1-ylpropyl] benzoate Traditional Name: benzoic acid [(1R)-1-pyridin-1-ium-1-ylpropyl] ester Formula: C15H16NO2+ MolecularWeight: 242.29304

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+]1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H]([N+]1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H16NO2/c1-2-14(16-11-7-4-8-12-16)18-15(17)13-9-5-3-6-10-13/h3-12,14H,2H2,1H3/q+1/t14-/m1/s1