(1-methylpiperidin-1-ium-4-yl) 2-phenoxyethanoate

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 2-phenoxyethanoate Openeye Name: (1-methylpiperidin-1-ium-4-yl) 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid (1-methyl-4-piperidin-1-iumyl) ester IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid (1-methylpiperidin-1-ium-4-yl) ester Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)COC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C14H19NO3/c1-15-9-7-13(8-10-15)18-14(16)11-17-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3/p+1