2-(5-methoxy-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate

Systemtic Name: 2-(5-methoxy-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate Openeye Name: 2-(5-methoxy-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate CAS Name: sulfuric acid 2-(5-methoxy-2,4-dimethylphenyl)sulfonylethyl ester IUPAC Name: 2-(5-methoxy-2,4-dimethylphenyl)sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(5-methoxy-2,4-dimethyl-phenyl)sulfonylethyl ester Formula: C11H16O7S2 MolecularWeight: 324.37054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC)S(=O)(=O)CCOS(=O)(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1OC)S(=O)(=O)CCOS(=O)(=O)O)C

InChI

InChI=1S/C11H16O7S2/c1-8-6-9(2)11(7-10(8)17-3)19(12,13)5-4-18-20(14,15)16/h6-7H,4-5H2,1-3H3,(H,14,15,16)