1-benzofuran-2-yl-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[4-(2,6-dimethyl-4-pyrimidin-3-iumyl)-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazino]methanone Formula: C19H21N4O2+ MolecularWeight: 337.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C19H20N4O2/c1-13-11-18(21-14(2)20-13)22-7-9-23(10-8-22)19(24)17-12-15-5-3-4-6-16(15)25-17/h3-6,11-12H,7-10H2,1-2H3/p+1