(4-methoxycarbonylphenyl) 2-morpholin-4-ylpyridin-1-ium-3-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 2-morpholin-4-ylpyridin-1-ium-3-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 2-morpholinopyridin-1-ium-3-carboxylate CAS Name: 2-(4-morpholinyl)-3-pyridin-1-iumcarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 2-morpholin-4-ylpyridin-1-ium-3-carboxylate Traditional Name: 2-morpholinopyridin-1-ium-3-carboxylic acid (4-carbomethoxyphenyl) ester Formula: C18H19N2O5+ MolecularWeight: 343.35386

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(=O)C2=C([NH+]=CC=C2)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(=O)C2=C([NH+]=CC=C2)N3CCOCC3

InChI

InChI=1S/C18H18N2O5/c1-23-17(21)13-4-6-14(7-5-13)25-18(22)15-3-2-8-19-16(15)20-9-11-24-12-10-20/h2-8H,9-12H2,1H3/p+1