3-(ethoxymethyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(ethoxymethyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(ethoxymethyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzofuran-2-carboxamide CAS Name: 3-(ethoxymethyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-benzofurancarboxamide IUPAC Name: 3-(ethoxymethyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 3-(ethoxymethyl)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]coumarilamide Formula: C25H31N2O3+ MolecularWeight: 407.52524

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

InChI

InChI=1S/C25H30N2O3/c1-2-29-18-22-21-12-6-7-13-23(21)30-24(22)25(28)26-16-19-10-4-5-11-20(19)17-27-14-8-3-9-15-27/h4-7,10-13H,2-3,8-9,14-18H2,1H3,(H,26,28)/p+1