(2R)-1-(3-bromanylcarbazol-9-yl)-3-(4-cyclohexylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(3-bromanylcarbazol-9-yl)-3-(4-cyclohexylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(3-bromocarbazol-9-yl)-3-(4-cyclohexylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(3-bromo-9-carbazolyl)-3-(4-cyclohexyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-(3-bromocarbazol-9-yl)-3-(4-cyclohexylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(3-bromocarbazol-9-yl)-3-(4-cyclohexylpiperazin-4-ium-1-yl)propan-2-ol Formula: C25H33BrN3O+ MolecularWeight: 471.45302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)CC(CN3C4=C(C=C(C=C4)Br)C5=CC=CC=C53)O

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C[C@H](CN3C4=C(C=C(C=C4)Br)C5=CC=CC=C53)O

InChI

InChI=1S/C25H32BrN3O/c26-19-10-11-25-23(16-19)22-8-4-5-9-24(22)29(25)18-21(30)17-27-12-14-28(15-13-27)20-6-2-1-3-7-20/h4-5,8-11,16,20-21,30H,1-3,6-7,12-15,17-18H2/p+1/t21-/m1/s1