[3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxyphenyl] benzenesulfonate

Systemtic Name: [3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxyphenyl] benzenesulfonate Openeye Name: [3-[ethoxy(sec-butylsulfanyl)phosphoryl]oxyphenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[(butan-2-ylthio)-ethoxyphosphoryl]oxyphenyl] ester IUPAC Name: [3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]oxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-[ethoxy-(sec-butylthio)phosphoryl]oxyphenyl] ester Formula: C18H23O6PS2 MolecularWeight: 430.475381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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