N-(4-methoxyphenyl)-2-methyl-5-oxidanyl-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-1-benzofuran-3-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-2-methyl-5-oxidanyl-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-1-benzofuran-3-carboxamide Openeye Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-5-hydroxy-N-(4-methoxyphenyl)-2-methyl-benzofuran-3-carboxamide CAS Name: 5-hydroxy-N-(4-methoxyphenyl)-2-methyl-4-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-3-benzofurancarboxamide IUPAC Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-5-hydroxy-N-(4-methoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide Traditional Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-5-hydroxy-N-(4-methoxyphenyl)-2-methyl-benzofuran-3-carboxamide Formula: C29H32N3O4+ MolecularWeight: 486.58208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCN(CC3)CC4=CC=CC=C4)O)C(=O)NC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCN(CC3)CC4=CC=CC=C4)O)C(=O)NC5=CC=C(C=C5)OC

InChI

InChI=1S/C29H31N3O4/c1-20-27(29(34)30-22-8-10-23(35-2)11-9-22)28-24(25(33)12-13-26(28)36-20)19-32-16-14-31(15-17-32)18-21-6-4-3-5-7-21/h3-13,33H,14-19H2,1-2H3,(H,30,34)/p+1