diphenoxyphosphoryl 4-methylbenzenesulfonate

Systemtic Name: diphenoxyphosphoryl 4-methylbenzenesulfonate Openeye Name: diphenoxyphosphoryl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid diphenoxyphosphoryl ester IUPAC Name: diphenoxyphosphoryl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid diphenoxyphosphoryl ester Formula: C19H17O6PS MolecularWeight: 404.373441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H17O6PS/c1-16-12-14-19(15-13-16)27(21,22)25-26(20,23-17-8-4-2-5-9-17)24-18-10-6-3-7-11-18/h2-15H,1H3