phenyl 4-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxybenzenesulfonate

Systemtic Name: phenyl 4-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxybenzenesulfonate Openeye Name: phenyl 4-[ethoxy(sec-butylsulfanyl)phosphoryl]oxybenzenesulfonate CAS Name: 4-[(butan-2-ylthio)-ethoxyphosphoryl]oxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxybenzenesulfonate Traditional Name: 4-[ethoxy-(sec-butylthio)phosphoryl]oxybenzenesulfonic acid phenyl ester Formula: C18H23O6PS2 MolecularWeight: 430.475381

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SP(=O)(OCC)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CCC(C)SP(=O)(OCC)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H23O6PS2/c1-4-15(3)26-25(19,22-5-2)23-16-11-13-18(14-12-16)27(20,21)24-17-9-7-6-8-10-17/h6-15H,4-5H2,1-3H3