N-[2-[1-(1,3-benzodioxol-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[1-(1,3-benzodioxol-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[1-(1,3-benzodioxol-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[1-(1,3-benzodioxol-4-ylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[1-(1,3-benzodioxol-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[1-(1,3-benzodioxol-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-piperonylamide Formula: C24H25N4O5+ MolecularWeight: 449.4791

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=C6C(=CC=C5)OCO6

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=C6C(=CC=C5)OCO6

InChI

InChI=1S/C24H24N4O5/c29-24(16-4-5-19-21(12-16)32-14-30-19)26-22-6-9-25-28(22)18-7-10-27(11-8-18)13-17-2-1-3-20-23(17)33-15-31-20/h1-6,9,12,18H,7-8,10-11,13-15H2,(H,26,29)/p+1