potassium; bis(2,2-dimethylpropanoyloxy)methoxy-oxidanylidene-(3-phenoxyphenyl)phosphanium; butane-1-sulfonate

Systemtic Name: potassium; bis(2,2-dimethylpropanoyloxy)methoxy-oxidanylidene-(3-phenoxyphenyl)phosphanium; butane-1-sulfonate Openeye Name: potassium; bis(2,2-dimethylpropanoyloxy)methoxy-oxo-(3-phenoxyphenyl)phosphonium; butane-1-sulfonate CAS Name: potassium; bis(2,2-dimethyl-1-oxopropoxy)methoxy-oxo-(3-phenoxyphenyl)phosphonium; 1-butanesulfonate IUPAC Name: potassium; bis(2,2-dimethylpropanoyloxy)methoxy-oxo-(3-phenoxyphenyl)phosphanium; butane-1-sulfonate Traditional Name: potassium; butane-1-sulfonate; dipivaloyloxymethoxy-keto-(3-phenoxyphenyl)phosphonium Formula: C27H37KO10PS+ MolecularWeight: 623.713741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)[O-].CC(C)(C)C(=O)OC(OC(=O)C(C)(C)C)O[P+](=O)C1=CC=CC(=C1)OC2=CC=CC=C2.[K+]

Isomeric SMILES

CCCCS(=O)(=O)[O-].CC(C)(C)C(=O)OC(OC(=O)C(C)(C)C)O[P+](=O)C1=CC=CC(=C1)OC2=CC=CC=C2.[K+]

InChI

InChI=1S/C23H28O7P.C4H10O3S.K/c1-22(2,3)19(24)28-21(29-20(25)23(4,5)6)30-31(26)18-14-10-13-17(15-18)27-16-11-8-7-9-12-16;1-2-3-4-8(5,6)7;/h7-15,21H,1-6H3;2-4H2,1H3,(H,5,6,7);/q+1;;+1/p-1