2-(1-diethoxyphosphoryl-2-phenylmethoxy-ethoxy)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(1-diethoxyphosphoryl-2-phenylmethoxy-ethoxy)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(2-benzyloxy-1-diethoxyphosphoryl-ethoxy)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(1-diethoxyphosphoryl-2-phenylmethoxyethoxy)ethyl ester IUPAC Name: 2-(1-diethoxyphosphoryl-2-phenylmethoxyethoxy)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(2-benzoxy-1-diethoxyphosphoryl-ethoxy)ethyl ester Formula: C22H31O8PS MolecularWeight: 486.515501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(COCC1=CC=CC=C1)OCCOS(=O)(=O)C2=CC=C(C=C2)C)OCC

Isomeric SMILES

CCOP(=O)(C(COCC1=CC=CC=C1)OCCOS(=O)(=O)C2=CC=C(C=C2)C)OCC

InChI

InChI=1S/C22H31O8PS/c1-4-28-31(23,29-5-2)22(18-26-17-20-9-7-6-8-10-20)27-15-16-30-32(24,25)21-13-11-19(3)12-14-21/h6-14,22H,4-5,15-18H2,1-3H3