2-diethoxyphosphorylsulfanyl-2-(2,2-dimethylpropoxy)-1,3,2-benzodioxaphosphol-2-ium chloride

Systemtic Name: 2-diethoxyphosphorylsulfanyl-2-(2,2-dimethylpropoxy)-1,3,2-benzodioxaphosphol-2-ium chloride Openeye Name: 2-diethoxyphosphorylsulfanyl-2-(2,2-dimethylpropoxy)-1,3,2-benzodioxaphosphol-2-ium chloride CAS Name: 2-(diethoxyphosphorylthio)-2-(2,2-dimethylpropoxy)-1,3,2-benzodioxaphosphol-2-ium chloride IUPAC Name: 2-diethoxyphosphorylsulfanyl-2-(2,2-dimethylpropoxy)-1,3,2-benzodioxaphosphol-2-ium chloride Traditional Name: 2-(diethoxyphosphorylthio)-2-neopentyloxy-1,3,2-benzodioxaphosphol-2-ium chloride Formula: C15H25ClO6P2S MolecularWeight: 430.820922

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)S[P+]1(OC2=CC=CC=C2O1)OCC(C)(C)C.[Cl-]

Isomeric SMILES

CCOP(=O)(OCC)S[P+]1(OC2=CC=CC=C2O1)OCC(C)(C)C.[Cl-]

InChI

InChI=1S/C15H25O6P2S.ClH/c1-6-17-22(16,18-7-2)24-23(19-12-15(3,4)5)20-13-10-8-9-11-14(13)21-23;/h8-11H,6-7,12H2,1-5H3;1H/q+1;/p-1