1-(1,2-oxazol-3-yloxy)propyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate

Systemtic Name: 1-(1,2-oxazol-3-yloxy)propyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate Openeye Name: 1-isoxazol-3-yloxypropyl 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylate CAS Name: 2-(aminomethyl)-1-ethyl-3-pyridin-1-iumcarboxylic acid 1-(3-isoxazolyloxy)propyl ester IUPAC Name: 1-(1,2-oxazol-3-yloxy)propyl 2-(aminomethyl)-1-ethylpyridin-1-ium-3-carboxylate Traditional Name: 2-(aminomethyl)-1-ethyl-pyridin-1-ium-3-carboxylic acid 1-isoxazol-3-yloxypropyl ester Formula: C15H20N3O4+ MolecularWeight: 306.337

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=NOC=C1)OC(=O)C2=C([N+](=CC=C2)CC)CN

Isomeric SMILES

CCC(OC1=NOC=C1)OC(=O)C2=C([N+](=CC=C2)CC)CN

InChI

InChI=1S/C15H20N3O4/c1-3-14(21-13-7-9-20-17-13)22-15(19)11-6-5-8-18(4-2)12(11)10-16/h5-9,14H,3-4,10,16H2,1-2H3/q+1