[1-(phenylmethyl)pyridin-1-ium-4-yl]methyl benzoate

Systemtic Name: [1-(phenylmethyl)pyridin-1-ium-4-yl]methyl benzoate Openeye Name: (1-benzylpyridin-1-ium-4-yl)methyl benzoate CAS Name: benzoic acid [1-(phenylmethyl)-4-pyridin-1-iumyl]methyl ester IUPAC Name: (1-benzylpyridin-1-ium-4-yl)methyl benzoate Traditional Name: benzoic acid (1-benzylpyridin-1-ium-4-yl)methyl ester Formula: C20H18NO2+ MolecularWeight: 304.36242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)COC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18NO2/c22-20(19-9-5-2-6-10-19)23-16-18-11-13-21(14-12-18)15-17-7-3-1-4-8-17/h1-14H,15-16H2/q+1