N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-fluoro-4-methyl-benzamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-3-fluoro-4-methylbenzamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-fluoro-4-methyl-benzamide Formula: C21H27FN3O+ MolecularWeight: 356.456983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O/c1-4-24-9-11-25(12-10-24)20-8-7-18(13-16(20)3)23-21(26)17-6-5-15(2)19(22)14-17/h5-8,13-14H,4,9-12H2,1-3H3,(H,23,26)/p+1