N-(3,4-dimethoxyphenyl)-2-[5-methoxy-2-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-2-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-2-(morpholin-4-ium-4-ylmethyl)-4-oxo-1-pyridyl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-2-(4-morpholin-4-iumylmethyl)-4-oxo-1-pyridinyl]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-2-(morpholin-4-ium-4-ylmethyl)-4-oxopyridin-1-yl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-keto-5-methoxy-2-(morpholin-4-ium-4-ylmethyl)-1-pyridyl]acetamide Formula: C21H28N3O6+ MolecularWeight: 418.46352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2C=C(C(=O)C=C2C[NH+]3CCOCC3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2C=C(C(=O)C=C2C[NH+]3CCOCC3)OC)OC

InChI

InChI=1S/C21H27N3O6/c1-27-18-5-4-15(10-19(18)28-2)22-21(26)14-24-13-20(29-3)17(25)11-16(24)12-23-6-8-30-9-7-23/h4-5,10-11,13H,6-9,12,14H2,1-3H3,(H,22,26)/p+1