1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-benzyl-4-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium CAS Name: 1-[1-[(4-fluorophenyl)methyl]-4-piperidin-1-iumyl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium Traditional Name: 1-benzyl-4-[1-(4-fluorobenzyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Formula: C23H33FN3+3 MolecularWeight: 370.526623

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H30FN3/c24-22-8-6-21(7-9-22)19-25-12-10-23(11-13-25)27-16-14-26(15-17-27)18-20-4-2-1-3-5-20/h1-9,23H,10-19H2/p+3