N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-4-fluoro-benzamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-4-fluorobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-4-fluorobenzamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-4-fluoro-benzamide Formula: C20H25FN3O+ MolecularWeight: 342.430403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24FN3O/c1-3-23-10-12-24(13-11-23)18-8-9-19(15(2)14-18)22-20(25)16-4-6-17(21)7-5-16/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)/p+1