(2S)-1-carbazol-9-yl-3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-carbazol-9-yl-3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-carbazol-9-yl-3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-(9-carbazolyl)-3-[4-(4-chlorophenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-carbazol-9-yl-3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-carbazol-9-yl-3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C25H27ClN3O+ MolecularWeight: 420.95438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H26ClN3O/c26-19-9-11-20(12-10-19)28-15-13-27(14-16-28)17-21(30)18-29-24-7-3-1-5-22(24)23-6-2-4-8-25(23)29/h1-12,21,30H,13-18H2/p+1/t21-/m1/s1