2-[ethoxy-(5-oxidanylidene-1-phenyl-decan-3-yl)phosphoryl]ethanoic acid

Systemtic Name: 2-[ethoxy-(5-oxidanylidene-1-phenyl-decan-3-yl)phosphoryl]ethanoic acid Openeye Name: 2-[ethoxy-(3-oxo-1-phenethyl-octyl)phosphoryl]acetic acid CAS Name: 2-[ethoxy-(5-oxo-1-phenyldecan-3-yl)phosphoryl]acetic acid IUPAC Name: 2-[ethoxy-(5-oxo-1-phenyldecan-3-yl)phosphoryl]acetic acid Traditional Name: 2-[ethoxy-(3-keto-1-phenethyl-octyl)phosphoryl]acetic acid Formula: C20H31O5P MolecularWeight: 382.430901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(CCC1=CC=CC=C1)P(=O)(CC(=O)O)OCC

Isomeric SMILES

CCCCCC(=O)CC(CCC1=CC=CC=C1)P(=O)(CC(=O)O)OCC

InChI

InChI=1S/C20H31O5P/c1-3-5-7-12-18(21)15-19(14-13-17-10-8-6-9-11-17)26(24,25-4-2)16-20(22)23/h6,8-11,19H,3-5,7,12-16H2,1-2H3,(H,22,23)