3-(methoxymethyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(methoxymethyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(methoxymethyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzofuran-2-carboxamide CAS Name: 3-(methoxymethyl)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-benzofurancarboxamide IUPAC Name: 3-(methoxymethyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 3-(methoxymethyl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]coumarilamide Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(OC2=CC=CC=C21)C(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

Isomeric SMILES

COCC1=C(OC2=CC=CC=C21)C(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C24H28N2O3/c1-28-17-21-20-7-3-4-8-22(20)29-23(21)24(27)25-15-18-9-11-19(12-10-18)16-26-13-5-2-6-14-26/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,25,27)/p+1