cyclohexyl 3-[ethoxy(propylsulfanyl)phosphoryl]oxybenzenesulfonate

Systemtic Name: cyclohexyl 3-[ethoxy(propylsulfanyl)phosphoryl]oxybenzenesulfonate Openeye Name: cyclohexyl 3-[ethoxy(propylsulfanyl)phosphoryl]oxybenzenesulfonate CAS Name: 3-[ethoxy-(propylthio)phosphoryl]oxybenzenesulfonic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[ethoxy(propylsulfanyl)phosphoryl]oxybenzenesulfonate Traditional Name: 3-[ethoxy-(propylthio)phosphoryl]oxybenzenesulfonic acid cyclohexyl ester Formula: C17H27O6PS2 MolecularWeight: 422.496441

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)OC1=CC(=CC=C1)S(=O)(=O)OC2CCCCC2

Isomeric SMILES

CCCSP(=O)(OCC)OC1=CC(=CC=C1)S(=O)(=O)OC2CCCCC2

InChI

InChI=1S/C17H27O6PS2/c1-3-13-25-24(18,21-4-2)22-16-11-8-12-17(14-16)26(19,20)23-15-9-6-5-7-10-15/h8,11-12,14-15H,3-7,9-10,13H2,1-2H3