2-[4-[(2-naphthalen-1-ylsulfanylphenyl)methyl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[(2-naphthalen-1-ylsulfanylphenyl)methyl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[[2-(1-naphthylsulfanyl)phenyl]methyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[[2-(1-naphthalenylthio)phenyl]methyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[(2-naphthalen-1-ylsulfanylphenyl)methyl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[2-(1-naphthylthio)benzyl]piperazin-4-ium-1-yl]ethanol Formula: C23H27N2OS+ MolecularWeight: 379.53828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2SC3=CC=CC4=CC=CC=C43)CCO

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2SC3=CC=CC4=CC=CC=C43)CCO

InChI

InChI=1S/C23H26N2OS/c26-17-16-24-12-14-25(15-13-24)18-20-7-2-4-10-22(20)27-23-11-5-8-19-6-1-3-9-21(19)23/h1-11,26H,12-18H2/p+1