[2-(4-nitrophenyl)-5-sulfanyl-1,3-oxazol-4-yl]-triphenyl-phosphanium

Systemtic Name: [2-(4-nitrophenyl)-5-sulfanyl-1,3-oxazol-4-yl]-triphenyl-phosphanium Openeye Name: [2-(4-nitrophenyl)-5-sulfanyl-oxazol-4-yl]-triphenyl-phosphonium CAS Name: [5-mercapto-2-(4-nitrophenyl)-4-oxazolyl]-triphenylphosphonium IUPAC Name: [2-(4-nitrophenyl)-5-sulfanyl-1,3-oxazol-4-yl]-triphenylphosphanium Traditional Name: [5-mercapto-2-(4-nitrophenyl)oxazol-4-yl]-triphenyl-phosphonium Formula: C27H20N2O3PS+ MolecularWeight: 483.498061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=C(OC(=N4)C5=CC=C(C=C5)[N+](=O)[O-])S

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=C(OC(=N4)C5=CC=C(C=C5)[N+](=O)[O-])S

InChI

InChI=1S/C27H19N2O3PS/c30-29(31)21-18-16-20(17-19-21)25-28-26(27(34)32-25)33(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19H/p+1