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

Systemtic Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-N-(4-methylphenyl)-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-hydroxy-2-methyl-N-(p-tolyl)benzofuran-3-carboxamide CAS Name: 4-[(4-ethyl-1-piperazin-4-iumyl)methyl]-5-hydroxy-2-methyl-N-(4-methylphenyl)-3-benzofurancarboxamide IUPAC Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-hydroxy-2-methyl-N-(4-methylphenyl)-1-benzofuran-3-carboxamide Traditional Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-hydroxy-2-methyl-N-(p-tolyl)benzofuran-3-carboxamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=CC=C(C=C4)C)O

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4=CC=C(C=C4)C)O

InChI

InChI=1S/C24H29N3O3/c1-4-26-11-13-27(14-12-26)15-19-20(28)9-10-21-23(19)22(17(3)30-21)24(29)25-18-7-5-16(2)6-8-18/h5-10,28H,4,11-15H2,1-3H3,(H,25,29)/p+1