[(1R)-1-(1-methylpyridin-1-ium-3-yl)ethyl] 3-chloranylbenzoate

Systemtic Name: [(1R)-1-(1-methylpyridin-1-ium-3-yl)ethyl] 3-chloranylbenzoate Openeye Name: [(1R)-1-(1-methylpyridin-1-ium-3-yl)ethyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [(1R)-1-(1-methyl-3-pyridin-1-iumyl)ethyl] ester IUPAC Name: [(1R)-1-(1-methylpyridin-1-ium-3-yl)ethyl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [(1R)-1-(1-methylpyridin-1-ium-3-yl)ethyl] ester Formula: C15H15ClNO2+ MolecularWeight: 276.7381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C[N+](=CC=C1)C)OC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClNO2/c1-11(13-6-4-8-17(2)10-13)19-15(18)12-5-3-7-14(16)9-12/h3-11H,1-2H3/q+1/t11-/m1/s1