N-(2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-[4-(p-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-[cyclopropyl(oxo)methyl]-3-benzofuranyl]-2-[4-(4-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(cyclopropanecarbonyl)-1-benzofuran-3-yl]-2-[4-(4-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-[4-(p-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=C(OC4=CC=CC=C43)C(=O)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=C(OC4=CC=CC=C43)C(=O)C5CC5

InChI

InChI=1S/C25H27N3O3/c1-17-6-10-19(11-7-17)28-14-12-27(13-15-28)16-22(29)26-23-20-4-2-3-5-21(20)31-25(23)24(30)18-8-9-18/h2-7,10-11,18H,8-9,12-16H2,1H3,(H,26,29)/p+1