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

Systemtic Name: (2R)-1-carbazol-9-yl-3-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-carbazol-9-yl-propan-2-ol CAS Name: (2R)-1-(9-carbazolyl)-3-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-2-propanol IUPAC Name: (2R)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-carbazol-9-ylpropan-2-ol Traditional Name: (2R)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-carbazol-9-yl-propan-2-ol Formula: C26H31N3O+2 MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(CN3C4=CC=CC=C4C5=CC=CC=C53)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)C[C@@H](CN3C4=CC=CC=C4C5=CC=CC=C53)O

InChI

InChI=1S/C26H29N3O/c30-22(19-28-16-14-27(15-17-28)18-21-8-2-1-3-9-21)20-29-25-12-6-4-10-23(25)24-11-5-7-13-26(24)29/h1-13,22,30H,14-20H2/p+2/t22-/m0/s1