5-(1-benzofuran-2-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole

Systemtic Name: 5-(1-benzofuran-2-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Openeye Name: 5-(benzofuran-2-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole CAS Name: 5-(2-benzofuranyl)-1-(1-methyl-4-piperidin-1-iumyl)-2H-imidazo[4,5-c]pyrazole IUPAC Name: 5-(1-benzofuran-2-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Traditional Name: 5-(benzofuran-2-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Formula: C18H20N5O+ MolecularWeight: 322.3843

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2C3=NC(=NC3=CN2)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C[NH+]1CCC(CC1)N2C3=NC(=NC3=CN2)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C18H19N5O/c1-22-8-6-13(7-9-22)23-18-14(11-19-23)20-17(21-18)16-10-12-4-2-3-5-15(12)24-16/h2-5,10-11,13,19H,6-9H2,1H3/p+1