(phenylmethyl) 2-[1-(hydroxymethyl)pyrrolidin-1-ium-1-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[1-(hydroxymethyl)pyrrolidin-1-ium-1-yl]oxyethanoate Openeye Name: benzyl 2-[1-(hydroxymethyl)pyrrolidin-1-ium-1-yl]oxyacetate CAS Name: 2-[[1-(hydroxymethyl)-1-pyrrolidin-1-iumyl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[1-(hydroxymethyl)pyrrolidin-1-ium-1-yl]oxyacetate Traditional Name: 2-(1-methylolpyrrolidin-1-ium-1-yl)oxyacetic acid benzyl ester Formula: C14H20NO4+ MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CO)OCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC[N+](C1)(CO)OCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H20NO4/c16-12-15(8-4-5-9-15)19-11-14(17)18-10-13-6-2-1-3-7-13/h1-3,6-7,16H,4-5,8-12H2/q+1