4-bromanyl-2-[[4-(1H-indol-3-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[4-(1H-indol-3-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Openeye Name: 4-bromo-2-[[4-(1H-indol-3-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol CAS Name: 4-bromo-2-[[4-(1H-indol-3-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]phenol IUPAC Name: 4-bromo-2-[[4-(1H-indol-3-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Traditional Name: 4-bromo-2-[[4-(1H-indol-3-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Formula: C20H24BrN3O+2 MolecularWeight: 402.32806

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=C(C=CC(=C2)Br)O)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=C(C=CC(=C2)Br)O)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H22BrN3O/c21-17-5-6-20(25)15(11-17)13-23-7-9-24(10-8-23)14-16-12-22-19-4-2-1-3-18(16)19/h1-6,11-12,22,25H,7-10,13-14H2/p+2