(3-phenyl-1,2-oxazol-5-yl)methyl 2-morpholin-4-ylpyridin-1-ium-3-carboxylate

Systemtic Name: (3-phenyl-1,2-oxazol-5-yl)methyl 2-morpholin-4-ylpyridin-1-ium-3-carboxylate Openeye Name: (3-phenylisoxazol-5-yl)methyl 2-morpholinopyridin-1-ium-3-carboxylate CAS Name: 2-(4-morpholinyl)-3-pyridin-1-iumcarboxylic acid (3-phenyl-5-isoxazolyl)methyl ester IUPAC Name: (3-phenyl-1,2-oxazol-5-yl)methyl 2-morpholin-4-ylpyridin-1-ium-3-carboxylate Traditional Name: 2-morpholinopyridin-1-ium-3-carboxylic acid (3-phenylisoxazol-5-yl)methyl ester Formula: C20H20N3O4+ MolecularWeight: 366.3905

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=[NH+]2)C(=O)OCC3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=CC=[NH+]2)C(=O)OCC3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O4/c24-20(17-7-4-8-21-19(17)23-9-11-25-12-10-23)26-14-16-13-18(22-27-16)15-5-2-1-3-6-15/h1-8,13H,9-12,14H2/p+1