dimethyl phosphate; (E)-4-oxidanyl-4-(1-phenylpropoxy)but-3-en-2-one

Systemtic Name: dimethyl phosphate; (E)-4-oxidanyl-4-(1-phenylpropoxy)but-3-en-2-one Openeye Name: dimethyl phosphate; (E)-4-hydroxy-4-(1-phenylpropoxy)but-3-en-2-one CAS Name: dimethyl phosphate; (E)-4-hydroxy-4-(1-phenylpropoxy)-3-buten-2-one IUPAC Name: dimethyl phosphate; (E)-4-hydroxy-4-(1-phenylpropoxy)but-3-en-2-one Traditional Name: dimethyl phosphate; (E)-4-hydroxy-4-(1-phenylpropoxy)but-3-en-2-one Formula: C15H22O7P- MolecularWeight: 345.304741

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)OC(=CC(=O)C)O.COP(=O)([O-])OC

Isomeric SMILES

CCC(C1=CC=CC=C1)O/C(=C/C(=O)C)/O.COP(=O)([O-])OC

InChI

InChI=1S/C13H16O3.C2H7O4P/c1-3-12(11-7-5-4-6-8-11)16-13(15)9-10(2)14;1-5-7(3,4)6-2/h4-9,12,15H,3H2,1-2H3;1-2H3,(H,3,4)/p-1/b13-9+;