N-(1,3-benzodioxol-5-ylmethyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(1-piperidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: 5-(piperidin-1-ium-1-ylmethyl)-N-piperonyl-2-furamide Formula: C19H23N2O4+ MolecularWeight: 343.39692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(O2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(O2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N2O4/c22-19(20-11-14-4-6-16-18(10-14)24-13-23-16)17-7-5-15(25-17)12-21-8-2-1-3-9-21/h4-7,10H,1-3,8-9,11-13H2,(H,20,22)/p+1