1,3-bis(diphenylphosphanyl)propane-1-sulfonic acid

Systemtic Name: 1,3-bis(diphenylphosphanyl)propane-1-sulfonic acid Openeye Name: 1,3-bis(diphenylphosphanyl)propane-1-sulfonic acid CAS Name: 1,3-bis(diphenylphosphino)-1-propanesulfonic acid IUPAC Name: 1,3-bis(diphenylphosphanyl)propane-1-sulfonic acid Traditional Name: 1,3-bis(diphenylphosphino)propane-1-sulfonic acid Formula: C27H26O3P2S MolecularWeight: 492.506062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(CCC(P(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)P(CCC(P(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H26O3P2S/c28-33(29,30)27(32(25-17-9-3-10-18-25)26-19-11-4-12-20-26)21-22-31(23-13-5-1-6-14-23)24-15-7-2-8-16-24/h1-20,27H,21-22H2,(H,28,29,30)