(2R)-1-carbazol-9-yl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-carbazol-9-yl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-carbazol-9-yl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(9-carbazolyl)-3-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-carbazol-9-yl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-carbazol-9-yl-3-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C23H26N5O+ MolecularWeight: 388.48544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=NC=CC=N5

Isomeric SMILES

C1CN(CC[NH+]1C[C@@H](CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=NC=CC=N5

InChI

InChI=1S/C23H25N5O/c29-18(16-26-12-14-27(15-13-26)23-24-10-5-11-25-23)17-28-21-8-3-1-6-19(21)20-7-2-4-9-22(20)28/h1-11,18,29H,12-17H2/p+1/t18-/m0/s1