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

Systemtic Name: (2S)-1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]propan-2-ol CAS Name: (2S)-1-(9-carbazolyl)-3-[4-[2-(4-methylphenoxy)ethyl]-1-piperazin-4-iumyl]-2-propanol IUPAC Name: (2S)-1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-carbazol-9-yl-3-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]propan-2-ol Formula: C28H34N3O2+ MolecularWeight: 444.58846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)CC(CN3C4=CC=CC=C4C5=CC=CC=C53)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C[C@@H](CN3C4=CC=CC=C4C5=CC=CC=C53)O

InChI

InChI=1S/C28H33N3O2/c1-22-10-12-24(13-11-22)33-19-18-29-14-16-30(17-15-29)20-23(32)21-31-27-8-4-2-6-25(27)26-7-3-5-9-28(26)31/h2-13,23,32H,14-21H2,1H3/p+1/t23-/m0/s1