cyclohexyl 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]butane-1-sulfonate

Systemtic Name: cyclohexyl 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]butane-1-sulfonate Openeye Name: cyclohexyl 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]butane-1-sulfonate CAS Name: 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]-1-butanesulfonic acid IUPAC Name: cyclohexyl 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]butane-1-sulfonate Traditional Name: 1-diethoxyphosphoryl-4-[4-(4-ethylphenyl)phenyl]butane-1-sulfonic acid cyclohexyl ester Formula: C28H41O6PS MolecularWeight: 536.660301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)OC3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)OC3CCCCC3

InChI

InChI=1S/C28H41O6PS/c1-4-23-15-19-25(20-16-23)26-21-17-24(18-22-26)11-10-14-28(35(29,32-5-2)33-6-3)36(30,31)34-27-12-8-7-9-13-27/h15-22,27-28H,4-14H2,1-3H3