(E)-3-(4-bromophenyl)-2-diethoxyphosphoryl-prop-2-enoic acid

Systemtic Name: (E)-3-(4-bromophenyl)-2-diethoxyphosphoryl-prop-2-enoic acid Openeye Name: (E)-3-(4-bromophenyl)-2-diethoxyphosphoryl-prop-2-enoic acid CAS Name: (E)-3-(4-bromophenyl)-2-diethoxyphosphoryl-2-propenoic acid IUPAC Name: (E)-3-(4-bromophenyl)-2-diethoxyphosphorylprop-2-enoic acid Traditional Name: (E)-3-(4-bromophenyl)-2-diethoxyphosphoryl-acrylic acid Formula: C13H16BrO5P MolecularWeight: 363.140901

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=CC1=CC=C(C=C1)Br)C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(/C(=C/C1=CC=C(C=C1)Br)/C(=O)O)OCC

InChI

InChI=1S/C13H16BrO5P/c1-3-18-20(17,19-4-2)12(13(15)16)9-10-5-7-11(14)8-6-10/h5-9H,3-4H2,1-2H3,(H,15,16)/b12-9+