(2S)-1-carbazol-9-yl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol

Systemtic Name: (2S)-1-carbazol-9-yl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol Openeye Name: (2S)-1-carbazol-9-yl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol CAS Name: (2S)-1-(9-carbazolyl)-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-carbazol-9-yl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol Traditional Name: (2S)-1-carbazol-9-yl-3-(4-pyridin-1-ium-2-ylpiperazino)propan-2-ol Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=CC=CC=[NH+]5

Isomeric SMILES

C1CN(CCN1C[C@@H](CN2C3=CC=CC=C3C4=CC=CC=C42)O)C5=CC=CC=[NH+]5

InChI

InChI=1S/C24H26N4O/c29-19(17-26-13-15-27(16-14-26)24-11-5-6-12-25-24)18-28-22-9-3-1-7-20(22)21-8-2-4-10-23(21)28/h1-12,19,29H,13-18H2/p+1/t19-/m0/s1