[3-[ethoxy(propylsulfanyl)phosphoryl]oxyphenyl] propane-2-sulfonate

Systemtic Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxyphenyl] propane-2-sulfonate Openeye Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxyphenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxyphenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [3-[ethoxy-(propylthio)phosphoryl]oxyphenyl] ester Formula: C14H23O6PS2 MolecularWeight: 382.432581

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)OC1=CC(=CC=C1)OS(=O)(=O)C(C)C

Isomeric SMILES

CCCSP(=O)(OCC)OC1=CC(=CC=C1)OS(=O)(=O)C(C)C

InChI

InChI=1S/C14H23O6PS2/c1-5-10-22-21(15,18-6-2)19-13-8-7-9-14(11-13)20-23(16,17)12(3)4/h7-9,11-12H,5-6,10H2,1-4H3