(E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)but-3-ene-1-sulfonic acid

Systemtic Name: (E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)but-3-ene-1-sulfonic acid Openeye Name: (E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)but-3-ene-1-sulfonic acid CAS Name: (E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)-3-butene-1-sulfonic acid IUPAC Name: (E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)but-3-ene-1-sulfonic acid Traditional Name: (E)-1-diethoxyphosphoryl-4-(4-phenoxyphenyl)but-3-ene-1-sulfonic acid Formula: C20H25O7PS MolecularWeight: 440.447061

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC=CC1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(C/C=C/C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)O)OCC

InChI

InChI=1S/C20H25O7PS/c1-3-25-28(21,26-4-2)20(29(22,23)24)12-8-9-17-13-15-19(16-14-17)27-18-10-6-5-7-11-18/h5-11,13-16,20H,3-4,12H2,1-2H3,(H,22,23,24)/b9-8+