5-ethyl-3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-ethyl-3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzofuran-2-carboxamide Openeye Name: 5-ethyl-3-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzofuran-2-carboxamide CAS Name: 5-ethyl-3-methyl-N-[(2S)-2-(5-methyl-2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]-2-benzofurancarboxamide IUPAC Name: 5-ethyl-3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 5-ethyl-3-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]coumarilamide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NCC(C3=CC=C(O3)C)[NH+]4CCC(CC4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC[C@@H](C3=CC=C(O3)C)[NH+]4CCC(CC4)C

InChI

InChI=1S/C25H32N2O3/c1-5-19-7-9-22-20(14-19)18(4)24(30-22)25(28)26-15-21(23-8-6-17(3)29-23)27-12-10-16(2)11-13-27/h6-9,14,16,21H,5,10-13,15H2,1-4H3,(H,26,28)/p+1/t21-/m0/s1