N-(3-fluorophenyl)-2-[4-(4-phenylphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(4-phenylphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[oxo-(4-phenylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H25FN3O2+ MolecularWeight: 418.483303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24FN3O2/c26-22-7-4-8-23(17-22)27-24(30)18-28-13-15-29(16-14-28)25(31)21-11-9-20(10-12-21)19-5-2-1-3-6-19/h1-12,17H,13-16,18H2,(H,27,30)/p+1