4-bromanyl-2-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-bromo-2-[[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 4-bromo-2-[[4-(1-naphthalenylmethyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-bromo-2-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 4-bromo-2-[[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C22H24BrN2O+ MolecularWeight: 412.34276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC(=C2)Br)O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC(=C2)Br)O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H23BrN2O/c23-20-8-9-22(26)19(14-20)16-25-12-10-24(11-13-25)15-18-6-3-5-17-4-1-2-7-21(17)18/h1-9,14,26H,10-13,15-16H2/p+1