1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine CAS Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Formula: C23H35FN5+ MolecularWeight: 400.555903

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C[NH+]2CCCC(C2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCCN1C=C(C(=N1)C)C[NH+]2CCC[C@@H](C2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H34FN5/c1-3-10-29-17-20(19(2)25-29)16-26-11-4-5-23(18-26)28-14-12-27(13-15-28)22-8-6-21(24)7-9-22/h6-9,17,23H,3-5,10-16,18H2,1-2H3/p+1/t23-/m0/s1