2-[2,3-bis(chloranyl)-4-(4-ethoxycarbonyl-2-ethyl-5-oxidanylidene-hexanoyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2,3-bis(chloranyl)-4-(4-ethoxycarbonyl-2-ethyl-5-oxidanylidene-hexanoyl)phenoxy]ethanoic acid Openeye Name: 2-[2,3-dichloro-4-(4-ethoxycarbonyl-2-ethyl-5-oxo-hexanoyl)phenoxy]acetic acid CAS Name: 2-[2,3-dichloro-4-(4-ethoxycarbonyl-2-ethyl-1,5-dioxohexyl)phenoxy]acetic acid IUPAC Name: 2-[2,3-dichloro-4-(4-ethoxycarbonyl-2-ethyl-5-oxohexanoyl)phenoxy]acetic acid Traditional Name: 2-[4-(4-carbethoxy-2-ethyl-5-keto-hexanoyl)-2,3-dichloro-phenoxy]acetic acid Formula: C19H22Cl2O7 MolecularWeight: 433.27978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(=O)C)C(=O)OCC)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl

Isomeric SMILES

CCC(CC(C(=O)C)C(=O)OCC)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl

InChI

InChI=1S/C19H22Cl2O7/c1-4-11(8-13(10(3)22)19(26)27-5-2)18(25)12-6-7-14(17(21)16(12)20)28-9-15(23)24/h6-7,11,13H,4-5,8-9H2,1-3H3,(H,23,24)