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

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-4-oxo-2-(1-piperidin-1-iumylmethyl)-1-pyridinyl]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-keto-5-methoxy-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetamide Formula: C22H30N3O5+ MolecularWeight: 416.4907

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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+]3CCCCC3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2C=C(C(=O)C=C2C[NH+]3CCCCC3)OC)OC

InChI

InChI=1S/C22H29N3O5/c1-28-19-8-7-16(11-20(19)29-2)23-22(27)15-25-14-21(30-3)18(26)12-17(25)13-24-9-5-4-6-10-24/h7-8,11-12,14H,4-6,9-10,13,15H2,1-3H3,(H,23,27)/p+1