2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-5-oxidanyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide

Systemtic Name: 2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-5-oxidanyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide Openeye Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzofuran-3-carboxamide CAS Name: 5-hydroxy-2-methyl-4-[(4-methyl-1-piperazin-4-iumyl)methyl]-N-[3-(trifluoromethyl)phenyl]-3-benzofurancarboxamide IUPAC Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzofuran-3-carboxamide Formula: C23H25F3N3O3+ MolecularWeight: 448.45811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2CN3CC[NH+](CC3)C)O)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2CN3CC[NH+](CC3)C)O)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H24F3N3O3/c1-14-20(22(31)27-16-5-3-4-15(12-16)23(24,25)26)21-17(18(30)6-7-19(21)32-14)13-29-10-8-28(2)9-11-29/h3-7,12,30H,8-11,13H2,1-2H3,(H,27,31)/p+1