N-(3-chloranyl-2-methyl-phenyl)-2-methyl-4-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-5-oxidanyl-1-benzofuran-3-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-methyl-4-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-5-hydroxy-2-methyl-4-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]benzofuran-3-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[[(3R)-3-methyl-1-piperidin-1-iumyl]methyl]-3-benzofurancarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-1-benzofuran-3-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-5-hydroxy-2-methyl-4-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]benzofuran-3-carboxamide Formula: C24H28ClN2O3+ MolecularWeight: 427.94372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=C(C(=CC=C4)Cl)C)O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=C(C(=CC=C4)Cl)C)O

InChI

InChI=1S/C24H27ClN2O3/c1-14-6-5-11-27(12-14)13-17-20(28)9-10-21-23(17)22(16(3)30-21)24(29)26-19-8-4-7-18(25)15(19)2/h4,7-10,14,28H,5-6,11-13H2,1-3H3,(H,26,29)/p+1/t14-/m1/s1