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

Systemtic Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(4-fluorophenyl)-4-[(3S)-1-(p-tolylmethyl)piperidin-1-ium-3-yl]piperazine CAS Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(4-methylphenyl)methyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(4-fluorophenyl)-4-[(3S)-1-(4-methylbenzyl)piperidin-1-ium-3-yl]piperazine Formula: C23H31FN3+ MolecularWeight: 368.510743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCCC(C2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H30FN3/c1-19-4-6-20(7-5-19)17-25-12-2-3-23(18-25)27-15-13-26(14-16-27)22-10-8-21(24)9-11-22/h4-11,23H,2-3,12-18H2,1H3/p+1/t23-/m0/s1