N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-4-oxo-2-(1-piperidin-1-iumylmethyl)-1-pyridinyl]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-4-oxo-2-(piperidin-1-ium-1-ylmethyl)pyridin-1-yl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-keto-5-methoxy-2-(piperidin-1-ium-1-ylmethyl)-1-pyridyl]acetamide Formula: C22H28N3O5+ MolecularWeight: 414.47482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)C[NH+]2CCCCC2)CC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CN(C(=CC1=O)C[NH+]2CCCCC2)CC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H27N3O5/c1-28-21-14-25(17(12-18(21)26)13-24-7-3-2-4-8-24)15-22(27)23-16-5-6-19-20(11-16)30-10-9-29-19/h5-6,11-12,14H,2-4,7-10,13,15H2,1H3,(H,23,27)/p+1