4-bromanyl-2-[[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Openeye Name: 4-bromo-2-[[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol CAS Name: 4-bromo-2-[[4-(1-naphthalenylmethyl)-1-piperazine-1,4-diiumyl]methyl]phenol IUPAC Name: 4-bromo-2-[[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Traditional Name: 4-bromo-2-[[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Formula: C22H25BrN2O+2 MolecularWeight: 413.3507

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC3=CC=CC=C32)CC4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC3=CC=CC=C32)CC4=C(C=CC(=C4)Br)O

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+2