[2-oxidanyl-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propyl]-triphenyl-phosphanium

Systemtic Name: [2-oxidanyl-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propyl]-triphenyl-phosphanium Openeye Name: [2-hydroxy-3-(2-oxo-1,3-benzothiazol-3-yl)propyl]-triphenyl-phosphonium CAS Name: [2-hydroxy-3-(2-oxo-1,3-benzothiazol-3-yl)propyl]-triphenylphosphonium IUPAC Name: [2-hydroxy-3-(2-oxo-1,3-benzothiazol-3-yl)propyl]-triphenylphosphanium Traditional Name: [2-hydroxy-3-(2-keto-1,3-benzothiazol-3-yl)propyl]-triphenyl-phosphonium Formula: C28H25NO2PS+ MolecularWeight: 470.542361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC(CN2C3=CC=CC=C3SC2=O)O)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC(CN2C3=CC=CC=C3SC2=O)O)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25NO2PS/c30-22(20-29-26-18-10-11-19-27(26)33-28(29)31)21-32(23-12-4-1-5-13-23,24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-19,22,30H,20-21H2/q+1