[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(1-oxidanidylpyridin-1-ium-3-yl)methanone

Systemtic Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(1-oxidanidylpyridin-1-ium-3-yl)methanone Openeye Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(1-oxidopyridin-1-ium-3-yl)methanone CAS Name: [4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-(1-oxido-3-pyridin-1-iumyl)methanone IUPAC Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(1-oxidopyridin-1-ium-3-yl)methanone Traditional Name: [4-[bis(4-fluorophenyl)methyl]piperazino]-(1-oxidopyridin-1-ium-3-yl)methanone Formula: C23H21F2N3O2 MolecularWeight: 409.428546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)C4=C[N+](=CC=C4)[O-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)C4=C[N+](=CC=C4)[O-]

InChI

InChI=1S/C23H21F2N3O2/c24-20-7-3-17(4-8-20)22(18-5-9-21(25)10-6-18)26-12-14-27(15-13-26)23(29)19-2-1-11-28(30)16-19/h1-11,16,22H,12-15H2