1-(2-fluorophenyl)-4-[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]piperazin-4-ium

Systemtic Name: 1-(2-fluorophenyl)-4-[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)-4-[(3S)-1-(3-pyridylmethyl)-3-piperidyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)-4-[(3S)-1-(3-pyridinylmethyl)-3-piperidinyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)-4-[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)-4-[(3S)-1-(3-pyridylmethyl)-3-piperidyl]piperazin-4-ium Formula: C21H28FN4+ MolecularWeight: 355.472223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H27FN4/c22-20-7-1-2-8-21(20)26-13-11-25(12-14-26)19-6-4-10-24(17-19)16-18-5-3-9-23-15-18/h1-3,5,7-9,15,19H,4,6,10-14,16-17H2/p+1/t19-/m0/s1