(phenylmethyl) 2-[2-(1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-(1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]ethanoate Openeye Name: benzyl 2-[2-(1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]acetate CAS Name: 2-[2-(1,3-dioxolan-2-yl)-1-pyridin-1-iumyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]acetate Traditional Name: 2-[2-(1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]acetic acid benzyl ester Formula: C17H18NO4+ MolecularWeight: 300.32912

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)C2=CC=CC=[N+]2CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1COC(O1)C2=CC=CC=[N+]2CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H18NO4/c19-16(22-13-14-6-2-1-3-7-14)12-18-9-5-4-8-15(18)17-20-10-11-21-17/h1-9,17H,10-13H2/q+1