N-(2-methoxydibenzofuran-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-methoxydibenzofuran-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-methoxydibenzofuran-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-methoxy-3-dibenzofuranyl)-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-methoxydibenzofuran-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-methoxydibenzofuran-3-yl)-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetamide Formula: C23H24N5O3+ MolecularWeight: 418.46836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C[NH+]4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C[NH+]4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C23H23N5O3/c1-30-21-13-17-16-5-2-3-6-19(16)31-20(17)14-18(21)26-22(29)15-27-9-11-28(12-10-27)23-24-7-4-8-25-23/h2-8,13-14H,9-12,15H2,1H3,(H,26,29)/p+1