1-(4-fluoranylnaphthalen-1-yl)-4-[1-(phenylmethyl)piperazin-1-ium-1-yl]cyclohexan-1-ol

Systemtic Name: 1-(4-fluoranylnaphthalen-1-yl)-4-[1-(phenylmethyl)piperazin-1-ium-1-yl]cyclohexan-1-ol Openeye Name: 4-(1-benzylpiperazin-1-ium-1-yl)-1-(4-fluoro-1-naphthyl)cyclohexanol CAS Name: 1-(4-fluoro-1-naphthalenyl)-4-[1-(phenylmethyl)-1-piperazin-1-iumyl]-1-cyclohexanol IUPAC Name: 4-(1-benzylpiperazin-1-ium-1-yl)-1-(4-fluoronaphthalen-1-yl)cyclohexan-1-ol Traditional Name: 4-(1-benzylpiperazin-1-ium-1-yl)-1-(4-fluoro-1-naphthyl)cyclohexanol Formula: C27H32FN2O+ MolecularWeight: 419.554183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1[N+]2(CCNCC2)CC3=CC=CC=C3)(C4=CC=C(C5=CC=CC=C54)F)O

Isomeric SMILES

C1CC(CCC1[N+]2(CCNCC2)CC3=CC=CC=C3)(C4=CC=C(C5=CC=CC=C54)F)O

InChI

InChI=1S/C27H32FN2O/c28-26-11-10-25(23-8-4-5-9-24(23)26)27(31)14-12-22(13-15-27)30(18-16-29-17-19-30)20-21-6-2-1-3-7-21/h1-11,22,29,31H,12-20H2/q+1