ethyl 2-[4-[butylsulfanyl(ethoxy)phosphoryl]oxyphenyl]carbonylbenzoate

Systemtic Name: ethyl 2-[4-[butylsulfanyl(ethoxy)phosphoryl]oxyphenyl]carbonylbenzoate Openeye Name: ethyl 2-[4-[butylsulfanyl(ethoxy)phosphoryl]oxybenzoyl]benzoate CAS Name: 2-[[4-[(butylthio)-ethoxyphosphoryl]oxyphenyl]-oxomethyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[4-[butylsulfanyl(ethoxy)phosphoryl]oxybenzoyl]benzoate Traditional Name: 2-[4-[(butylthio)-ethoxy-phosphoryl]oxybenzoyl]benzoic acid ethyl ester Formula: C22H27O6PS MolecularWeight: 450.484941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSP(=O)(OCC)OC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC

Isomeric SMILES

CCCCSP(=O)(OCC)OC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC

InChI

InChI=1S/C22H27O6PS/c1-4-7-16-30-29(25,27-6-3)28-18-14-12-17(13-15-18)21(23)19-10-8-9-11-20(19)22(24)26-5-2/h8-15H,4-7,16H2,1-3H3