1-(4-fluorophenyl)-4-(4-methylpiperazine-1,4-diium-1-yl)butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-(4-methylpiperazine-1,4-diium-1-yl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-(4-methylpiperazine-1,4-diium-1-yl)butan-1-one CAS Name: 1-(4-fluorophenyl)-4-(4-methyl-1-piperazine-1,4-diiumyl)-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-(4-methylpiperazine-1,4-diium-1-yl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-(4-methylpiperazine-1,4-diium-1-yl)butan-1-one Formula: C15H23FN2O+2 MolecularWeight: 266.354323

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H21FN2O/c1-17-9-11-18(12-10-17)8-2-3-15(19)13-4-6-14(16)7-5-13/h4-7H,2-3,8-12H2,1H3/p+2