N-(2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-[cyclopropyl(oxo)methyl]-3-benzofuranyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(cyclopropanecarbonyl)-1-benzofuran-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C24H26N3O3+ MolecularWeight: 404.48154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N3O3/c28-21(16-26-12-14-27(15-13-26)18-6-2-1-3-7-18)25-22-19-8-4-5-9-20(19)30-24(22)23(29)17-10-11-17/h1-9,17H,10-16H2,(H,25,28)/p+1