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

Systemtic Name: 2-methyl-N-(2-methylphenyl)-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: 5-hydroxy-2-methyl-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-N-(o-tolyl)benzofuran-3-carboxamide CAS Name: 5-hydroxy-2-methyl-N-(2-methylphenyl)-4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-3-benzofurancarboxamide IUPAC Name: 5-hydroxy-2-methyl-N-(2-methylphenyl)-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1-benzofuran-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-N-(o-tolyl)benzofuran-3-carboxamide Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=CC=CC=C4C)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=CC=CC=C4C)O

InChI

InChI=1S/C24H28N2O3/c1-15-7-6-12-26(13-15)14-18-20(27)10-11-21-23(18)22(17(3)29-21)24(28)25-19-9-5-4-8-16(19)2/h4-5,8-11,15,27H,6-7,12-14H2,1-3H3,(H,25,28)/p+1/t15-/m0/s1