2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-pyrrol-2-yl)ethanone Formula: C16H19FN3O+ MolecularWeight: 288.339963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)C2=CC=CN2)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)C2=CC=CN2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN3O/c17-13-3-5-14(6-4-13)20-10-8-19(9-11-20)12-16(21)15-2-1-7-18-15/h1-7,18H,8-12H2/p+1