1-[(3S)-1-[(3-fluorophenyl)methyl]piperidin-3-yl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(3S)-1-[(3-fluorophenyl)methyl]piperidin-3-yl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(3S)-1-[(3-fluorophenyl)methyl]-3-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(3S)-1-[(3-fluorophenyl)methyl]-3-piperidinyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(3S)-1-[(3-fluorophenyl)methyl]piperidin-3-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(3S)-1-(3-fluorobenzyl)-3-piperidyl]-4-phenyl-piperazin-1-ium Formula: C22H29FN3+ MolecularWeight: 354.484163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC(=CC=C2)F)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CC(=CC=C2)F)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28FN3/c23-20-7-4-6-19(16-20)17-24-11-5-10-22(18-24)26-14-12-25(13-15-26)21-8-2-1-3-9-21/h1-4,6-9,16,22H,5,10-15,17-18H2/p+1/t22-/m0/s1