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

Systemtic Name: 3-methyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]coumarilamide Formula: C23H27N2O2+ MolecularWeight: 363.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C23H26N2O2/c1-17-20-7-3-4-8-21(20)27-22(17)23(26)24-15-18-9-11-19(12-10-18)16-25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-16H2,1H3,(H,24,26)/p+1