ethyl 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butanoate

Systemtic Name: ethyl 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butanoate Openeye Name: ethyl 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butanoate CAS Name: 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butanoate Traditional Name: 2-(2-diethoxyphosphorylethyl)-4-(4-octylphenyl)butyric acid ethyl ester Formula: C26H45O5P MolecularWeight: 468.606261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H45O5P/c1-5-9-10-11-12-13-14-23-15-17-24(18-16-23)19-20-25(26(27)29-6-2)21-22-32(28,30-7-3)31-8-4/h15-18,25H,5-14,19-22H2,1-4H3