2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butanoic acid

Systemtic Name: 2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butanoic acid Openeye Name: 2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butanoic acid CAS Name: 2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butanoic acid IUPAC Name: 2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butanoic acid Traditional Name: 2-(2-diethoxyphosphorylethyl)-2-methyl-4-(4-octylphenyl)butyric acid Formula: C25H43O5P MolecularWeight: 454.579681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(C)(CCP(=O)(OCC)OCC)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(C)(CCP(=O)(OCC)OCC)C(=O)O

InChI

InChI=1S/C25H43O5P/c1-5-8-9-10-11-12-13-22-14-16-23(17-15-22)18-19-25(4,24(26)27)20-21-31(28,29-6-2)30-7-3/h14-17H,5-13,18-21H2,1-4H3,(H,26,27)