[5-(4-fluorophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [5-(4-fluorophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(4-fluorophenyl)-2-furyl]methanone CAS Name: [5-(4-fluorophenyl)-2-furanyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(4-fluorophenyl)furan-2-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(4-fluorophenyl)-2-furyl]methanone Formula: C22H22FN2O2+ MolecularWeight: 365.420683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(O3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(O3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O2/c23-19-8-6-18(7-9-19)20-10-11-21(27-20)22(26)25-14-12-24(13-15-25)16-17-4-2-1-3-5-17/h1-11H,12-16H2/p+1