1-[[1-[(4-fluorophenyl)methyl]-4-methyl-piperazin-1-ium-1-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[1-[(4-fluorophenyl)methyl]-4-methyl-piperazin-1-ium-1-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[1-[(4-fluorophenyl)methyl]-4-methyl-piperazin-1-ium-1-yl]methyl]pyrrolidin-2-one CAS Name: 1-[[1-[(4-fluorophenyl)methyl]-4-methyl-1-piperazin-1-iumyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[1-[(4-fluorophenyl)methyl]-4-methylpiperazin-1-ium-1-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[1-(4-fluorobenzyl)-4-methyl-piperazin-1-ium-1-yl]methyl]-2-pyrrolidone Formula: C17H25FN3O+ MolecularWeight: 306.398303

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](CC1)(CC2=CC=C(C=C2)F)CN3CCCC3=O

Isomeric SMILES

CN1CC[N+](CC1)(CC2=CC=C(C=C2)F)CN3CCCC3=O

InChI

InChI=1S/C17H25FN3O/c1-19-9-11-21(12-10-19,14-20-8-2-3-17(20)22)13-15-4-6-16(18)7-5-15/h4-7H,2-3,8-14H2,1H3/q+1