ethyl 2-[2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]ethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetyl]amino]acetate CAS Name: 2-[[2-[5-methoxy-4-oxo-2-(1-piperidin-1-iumylmethyl)-1-pyridinyl]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]acetyl]amino]acetate Traditional Name: 2-[[2-[4-keto-5-methoxy-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetyl]amino]acetic acid ethyl ester Formula: C18H28N3O5+ MolecularWeight: 366.43202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CN1C=C(C(=O)C=C1C[NH+]2CCCCC2)OC

Isomeric SMILES

CCOC(=O)CNC(=O)CN1C=C(C(=O)C=C1C[NH+]2CCCCC2)OC

InChI

InChI=1S/C18H27N3O5/c1-3-26-18(24)10-19-17(23)13-21-12-16(25-2)15(22)9-14(21)11-20-7-5-4-6-8-20/h9,12H,3-8,10-11,13H2,1-2H3,(H,19,23)/p+1