(2S)-1-(fluoren-9-ylideneamino)oxy-3-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(fluoren-9-ylideneamino)oxy-3-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-3-(fluoren-9-ylideneamino)oxy-propan-2-ol CAS Name: (2S)-1-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-3-(9-fluorenylideneamino)oxy-2-propanol IUPAC Name: (2S)-1-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-3-(fluoren-9-ylideneamino)oxypropan-2-ol Traditional Name: (2S)-1-(4-besylpiperazin-1-ium-1-yl)-3-(fluoren-9-ylideneamino)oxy-propan-2-ol Formula: C26H28N3O4S+ MolecularWeight: 478.58322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(CON=C2C3=CC=CC=C3C4=CC=CC=C42)O)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C[C@@H](CON=C2C3=CC=CC=C3C4=CC=CC=C42)O)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O4S/c30-20(18-28-14-16-29(17-15-28)34(31,32)21-8-2-1-3-9-21)19-33-27-26-24-12-6-4-10-22(24)23-11-5-7-13-25(23)26/h1-13,20,30H,14-19H2/p+1/t20-/m0/s1