N-(1,3-benzodioxol-5-yl)-2-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-5-methoxy-4-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-5-methoxy-4-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: 2-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-5-methoxy-4-oxo-1-pyridyl]-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[2-[(4-acetyl-1-piperazin-1-iumyl)methyl]-5-methoxy-4-oxo-1-pyridinyl]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-5-methoxy-4-oxopyridin-1-yl]-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-4-keto-5-methoxy-1-pyridyl]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C22H27N4O6+ MolecularWeight: 443.47298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=CC(=O)C(=CN2CC(=O)NC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=CC(=O)C(=CN2CC(=O)NC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H26N4O6/c1-15(27)25-7-5-24(6-8-25)11-17-10-18(28)21(30-2)12-26(17)13-22(29)23-16-3-4-19-20(9-16)32-14-31-19/h3-4,9-10,12H,5-8,11,13-14H2,1-2H3,(H,23,29)/p+1