N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-7-fluoranyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-7-fluoranyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-7-fluoro-3-methyl-benzofuran-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-7-fluoro-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-7-fluoro-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-7-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/c1-4-26-10-12-27(13-11-26)17-8-9-20(15(2)14-17)25-23(28)21-16(3)18-6-5-7-19(24)22(18)29-21/h5-9,14H,4,10-13H2,1-3H3,(H,25,28)/p+1