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

Systemtic Name: 2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-5-oxidanyl-N-phenyl-1-benzofuran-3-carboxamide Openeye Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-phenyl-benzofuran-3-carboxamide CAS Name: 5-hydroxy-2-methyl-4-[(4-methyl-1-piperazin-4-iumyl)methyl]-N-phenyl-3-benzofurancarboxamide IUPAC Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-phenyl-1-benzofuran-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-N-phenyl-benzofuran-3-carboxamide Formula: C22H26N3O3+ MolecularWeight: 380.46014

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3/c1-15-20(22(27)23-16-6-4-3-5-7-16)21-17(18(26)8-9-19(21)28-15)14-25-12-10-24(2)11-13-25/h3-9,26H,10-14H2,1-2H3,(H,23,27)/p+1