N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-5-fluoranyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-5-fluoranyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-5-fluoro-3-methyl-benzofuran-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-5-fluoro-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-5-fluoro-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-5-fluoro-3-methyl-coumarilamide Formula: C23H27FN3O2+ MolecularWeight: 396.477783

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)F)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)F)C)C

InChI

InChI=1S/C23H26FN3O2/c1-4-26-9-11-27(12-10-26)18-6-7-20(15(2)13-18)25-23(28)22-16(3)19-14-17(24)5-8-21(19)29-22/h5-8,13-14H,4,9-12H2,1-3H3,(H,25,28)/p+1