1-(3-bromanylcarbazol-9-yl)-3-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]propan-2-ol

Systemtic Name: 1-(3-bromanylcarbazol-9-yl)-3-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]propan-2-ol Openeye Name: 1-(4-benzylpiperazine-1,4-diium-1-yl)-3-(3-bromocarbazol-9-yl)propan-2-ol CAS Name: 1-(3-bromo-9-carbazolyl)-3-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-2-propanol IUPAC Name: 1-(4-benzylpiperazine-1,4-diium-1-yl)-3-(3-bromocarbazol-9-yl)propan-2-ol Traditional Name: 1-(4-benzylpiperazine-1,4-diium-1-yl)-3-(3-bromocarbazol-9-yl)propan-2-ol Formula: C26H30BrN3O+2 MolecularWeight: 480.4399

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(CN3C4=C(C=C(C=C4)Br)C5=CC=CC=C53)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(CN3C4=C(C=C(C=C4)Br)C5=CC=CC=C53)O

InChI

InChI=1S/C26H28BrN3O/c27-21-10-11-26-24(16-21)23-8-4-5-9-25(23)30(26)19-22(31)18-29-14-12-28(13-15-29)17-20-6-2-1-3-7-20/h1-11,16,22,31H,12-15,17-19H2/p+2