3-[2-(5-acetyloxypentyl)-3-(2-carboxyethyl)phenyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[2-(5-acetyloxypentyl)-3-(2-carboxyethyl)phenyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[2-(5-acetoxypentyl)-3-(2-carboxyethyl)phenyl]-2-oxo-propanoic acid CAS Name: 3-[2-(5-acetyloxypentyl)-3-(2-carboxyethyl)phenyl]-2-oxopropanoic acid IUPAC Name: 3-[2-(5-acetyloxypentyl)-3-(2-carboxyethyl)phenyl]-2-oxopropanoic acid Traditional Name: 3-[2-(5-acetoxypentyl)-3-(2-carboxyethyl)phenyl]-2-keto-propionic acid Formula: C19H24O7 MolecularWeight: 364.38966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCC1=C(C=CC=C1CCC(=O)O)CC(=O)C(=O)O

Isomeric SMILES

CC(=O)OCCCCCC1=C(C=CC=C1CCC(=O)O)CC(=O)C(=O)O

InChI

InChI=1S/C19H24O7/c1-13(20)26-11-4-2-3-8-16-14(9-10-18(22)23)6-5-7-15(16)12-17(21)19(24)25/h5-7H,2-4,8-12H2,1H3,(H,22,23)(H,24,25)