[2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]-phenyl-methanone

Systemtic Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]-phenyl-methanone Openeye Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]-phenyl-methanone CAS Name: [2-[[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-phenylmethanone IUPAC Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]-phenylmethanone Traditional Name: [2-[4-(2-fluorobenzyl)piperazin-4-ium-1-carbonyl]phenyl]-phenyl-methanone Formula: C25H24FN2O2+ MolecularWeight: 403.468663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H23FN2O2/c26-23-13-7-4-10-20(23)18-27-14-16-28(17-15-27)25(30)22-12-6-5-11-21(22)24(29)19-8-2-1-3-9-19/h1-13H,14-18H2/p+1