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

Systemtic Name: 1-diethoxyphosphoryl-4-[4-(4-propylphenyl)phenyl]butane-1-sulfonic acid Openeye Name: 1-diethoxyphosphoryl-4-[4-(4-propylphenyl)phenyl]butane-1-sulfonic acid CAS Name: 1-diethoxyphosphoryl-4-[4-(4-propylphenyl)phenyl]-1-butanesulfonic acid IUPAC Name: 1-diethoxyphosphoryl-4-[4-(4-propylphenyl)phenyl]butane-1-sulfonic acid Traditional Name: 1-diethoxyphosphoryl-4-[4-(4-propylphenyl)phenyl]butane-1-sulfonic acid Formula: C23H33O6PS MolecularWeight: 468.543281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)O

InChI

InChI=1S/C23H33O6PS/c1-4-8-19-11-15-21(16-12-19)22-17-13-20(14-18-22)9-7-10-23(31(25,26)27)30(24,28-5-2)29-6-3/h11-18,23H,4-10H2,1-3H3,(H,25,26,27)