(E)-4-[1-(4-chlorophenyl)ethoxy]-4-oxidanyl-but-3-en-2-one; diethyl phosphate

Systemtic Name: (E)-4-[1-(4-chlorophenyl)ethoxy]-4-oxidanyl-but-3-en-2-one; diethyl phosphate Openeye Name: (E)-4-[1-(4-chlorophenyl)ethoxy]-4-hydroxy-but-3-en-2-one; diethyl phosphate CAS Name: (E)-4-[1-(4-chlorophenyl)ethoxy]-4-hydroxy-3-buten-2-one; diethyl phosphate IUPAC Name: (E)-4-[1-(4-chlorophenyl)ethoxy]-4-hydroxybut-3-en-2-one; diethyl phosphate Traditional Name: (E)-4-[1-(4-chlorophenyl)ethoxy]-4-hydroxy-but-3-en-2-one; diethyl phosphate Formula: C16H23ClO7P- MolecularWeight: 393.776381

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)([O-])OCC.CC(C1=CC=C(C=C1)Cl)OC(=CC(=O)C)O

Isomeric SMILES

CCOP(=O)([O-])OCC.CC(C1=CC=C(C=C1)Cl)O/C(=C/C(=O)C)/O

InChI

InChI=1S/C12H13ClO3.C4H11O4P/c1-8(14)7-12(15)16-9(2)10-3-5-11(13)6-4-10;1-3-7-9(5,6)8-4-2/h3-7,9,15H,1-2H3;3-4H2,1-2H3,(H,5,6)/p-1/b12-7+;