2-(azocan-1-ium-1-yl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(azocan-1-ium-1-yl)acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1-azocan-1-iumyl)acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(azocan-1-ium-1-yl)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(azocan-1-ium-1-yl)acetamide Formula: C18H25N2O4+ MolecularWeight: 333.4021

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+]3CCCCCCC3)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+]3CCCCCCC3)OCO2

InChI

InChI=1S/C18H24N2O4/c1-13(21)14-9-16-17(24-12-23-16)10-15(14)19-18(22)11-20-7-5-3-2-4-6-8-20/h9-10H,2-8,11-12H2,1H3,(H,19,22)/p+1