1-(4-tert-butylphenoxy)propan-2-yl hydrogen sulfite

Systemtic Name: 1-(4-tert-butylphenoxy)propan-2-yl hydrogen sulfite Openeye Name: [2-(4-tert-butylphenoxy)-1-methyl-ethyl] hydrogen sulfite CAS Name: sulfurous acid 1-(4-tert-butylphenoxy)propan-2-yl ester IUPAC Name: 1-(4-tert-butylphenoxy)propan-2-yl hydrogen sulfite Traditional Name: sulfurous acid [2-(4-tert-butylphenoxy)-1-methyl-ethyl] ester Formula: C13H20O4S MolecularWeight: 272.3605

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)C(C)(C)C)OS(=O)O

Isomeric SMILES

CC(COC1=CC=C(C=C1)C(C)(C)C)OS(=O)O

InChI

InChI=1S/C13H20O4S/c1-10(17-18(14)15)9-16-12-7-5-11(6-8-12)13(2,3)4/h5-8,10H,9H2,1-4H3,(H,14,15)