1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]butane-1-sulfonic acid

Systemtic Name: 1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]butane-1-sulfonic acid Openeye Name: 1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]butane-1-sulfonic acid CAS Name: 1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]-1-butanesulfonic acid IUPAC Name: 1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]butane-1-sulfonic acid Traditional Name: 1-diethoxyphosphoryl-4-[3-(2-propylphenoxy)phenyl]butane-1-sulfonic acid Formula: C23H33O7PS MolecularWeight: 484.542681

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OC2=CC=CC(=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)O

Isomeric SMILES

CCCC1=CC=CC=C1OC2=CC=CC(=C2)CCCC(P(=O)(OCC)OCC)S(=O)(=O)O

InChI

InChI=1S/C23H33O7PS/c1-4-11-20-14-7-8-16-22(20)30-21-15-9-12-19(18-21)13-10-17-23(32(25,26)27)31(24,28-5-2)29-6-3/h7-9,12,14-16,18,23H,4-6,10-11,13,17H2,1-3H3,(H,25,26,27)