3-sulfobenzoate; tetraphenylphosphanium

Systemtic Name: 3-sulfobenzoate; tetraphenylphosphanium Openeye Name: 3-sulfobenzoate; tetraphenylphosphonium CAS Name: 3-sulfobenzoate; tetraphenylphosphonium IUPAC Name: 3-sulfobenzoate; tetraphenylphosphanium Traditional Name: 3-sulfobenzoate; tetraphenylphosphonium Formula: C31H25O5PS MolecularWeight: 540.565961

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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=CC=CC=C4.C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-]

InChI

InChI=1S/C24H20P.C7H6O5S/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;8-7(9)5-2-1-3-6(4-5)13(10,11)12/h1-20H;1-4H,(H,8,9)(H,10,11,12)/q+1;/p-1