2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-[3-methyl-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-[3-methyl-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(2,4-dihydroxy-3-methyl-phenyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(2,4-dihydroxy-3-methylphenyl)-2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(2,4-dihydroxy-3-methylphenyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(2,4-dihydroxy-3-methyl-phenyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanone Formula: C19H22FN2O3+ MolecularWeight: 345.387983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F)O

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F)O

InChI

InChI=1S/C19H21FN2O3/c1-13-17(23)7-6-14(19(13)25)18(24)12-21-8-10-22(11-9-21)16-5-3-2-4-15(16)20/h2-7,23,25H,8-12H2,1H3/p+1