3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(tetradecanoylamino)propanoic acid

Systemtic Name: 3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(tetradecanoylamino)propanoic acid Openeye Name: 3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(tetradecanoylamino)propanoic acid CAS Name: 3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(1-oxotetradecylamino)propanoic acid IUPAC Name: 3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(tetradecanoylamino)propanoic acid Traditional Name: 3-[4-(diethoxyphosphorylmethyl)phenyl]-2-(tetradecanoylamino)propionic acid Formula: C28H48NO6P MolecularWeight: 525.657581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)C(=O)O

InChI

InChI=1S/C28H48NO6P/c1-4-7-8-9-10-11-12-13-14-15-16-17-27(30)29-26(28(31)32)22-24-18-20-25(21-19-24)23-36(33,34-5-2)35-6-3/h18-21,26H,4-17,22-23H2,1-3H3,(H,29,30)(H,31,32)