[2-[ethoxy(pentylsulfanyl)phosphoryl]oxyphenyl] benzenesulfonate

Systemtic Name: [2-[ethoxy(pentylsulfanyl)phosphoryl]oxyphenyl] benzenesulfonate Openeye Name: [2-[ethoxy(pentylsulfanyl)phosphoryl]oxyphenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[ethoxy-(pentylthio)phosphoryl]oxyphenyl] ester IUPAC Name: [2-[ethoxy(pentylsulfanyl)phosphoryl]oxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[(amylthio)-ethoxy-phosphoryl]oxyphenyl] ester Formula: C19H25O6PS2 MolecularWeight: 444.501961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCSP(=O)(OCC)OC1=CC=CC=C1OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCSP(=O)(OCC)OC1=CC=CC=C1OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H25O6PS2/c1-3-5-11-16-27-26(20,23-4-2)24-18-14-9-10-15-19(18)25-28(21,22)17-12-7-6-8-13-17/h6-10,12-15H,3-5,11,16H2,1-2H3