N-(3-fluorophenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[3-(p-tolyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[3-(4-methylphenyl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[3-(p-tolyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C22H27FN3O2+ MolecularWeight: 384.467083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C22H26FN3O2/c1-17-5-7-18(8-6-17)9-10-22(28)26-13-11-25(12-14-26)16-21(27)24-20-4-2-3-19(23)15-20/h2-8,15H,9-14,16H2,1H3,(H,24,27)/p+1