1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]butane-1-sulfonic acid

Systemtic Name: 1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]butane-1-sulfonic acid Openeye Name: 1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]butane-1-sulfonic acid CAS Name: 1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]-1-butanesulfonic acid IUPAC Name: 1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]butane-1-sulfonic acid Traditional Name: 1-diethoxyphosphoryl-4-[4-(3-phenylpropyl)phenyl]butane-1-sulfonic acid Formula: C23H33O6PS MolecularWeight: 468.543281

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCC1=CC=C(C=C1)CCCC2=CC=CC=C2)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CCCC1=CC=C(C=C1)CCCC2=CC=CC=C2)S(=O)(=O)O)OCC

InChI

InChI=1S/C23H33O6PS/c1-3-28-30(24,29-4-2)23(31(25,26)27)15-9-14-22-18-16-21(17-19-22)13-8-12-20-10-6-5-7-11-20/h5-7,10-11,16-19,23H,3-4,8-9,12-15H2,1-2H3,(H,25,26,27)