(E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)but-3-en-2-one

Systemtic Name: (E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)but-3-en-2-one Openeye Name: (E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)but-3-en-2-one CAS Name: (E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)-3-buten-2-one IUPAC Name: (E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)but-3-en-2-one Traditional Name: (E)-3-diethoxyphosphoryl-4-(4-nitrophenyl)but-3-en-2-one Formula: C14H18NO6P MolecularWeight: 327.269581

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C)OCC

Isomeric SMILES

CCOP(=O)(/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)C)OCC

InChI

InChI=1S/C14H18NO6P/c1-4-20-22(19,21-5-2)14(11(3)16)10-12-6-8-13(9-7-12)15(17)18/h6-10H,4-5H2,1-3H3/b14-10+