1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]butane-1-sulfonic acid

Systemtic Name: 1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]butane-1-sulfonic acid Openeye Name: 1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]butane-1-sulfonic acid CAS Name: 1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]-1-butanesulfonic acid IUPAC Name: 1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]butane-1-sulfonic acid Traditional Name: 1-diethoxyphosphoryl-4-[4-(4-phenylphenyl)phenyl]butane-1-sulfonic acid Formula: C26H31O6PS MolecularWeight: 502.559501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)S(=O)(=O)O)OCC

InChI

InChI=1S/C26H31O6PS/c1-3-31-33(27,32-4-2)26(34(28,29)30)12-8-9-21-13-15-23(16-14-21)25-19-17-24(18-20-25)22-10-6-5-7-11-22/h5-7,10-11,13-20,26H,3-4,8-9,12H2,1-2H3,(H,28,29,30)