3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]coumarilamide Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC3=CN=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC3=CN=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H22N4O2/c1-14-16-5-3-4-6-17(16)26-19(14)20(25)22-15-7-8-18(21-13-15)24-11-9-23(2)10-12-24/h3-8,13H,9-12H2,1-2H3,(H,22,25)/p+1