[3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propyl-phenyl] hydrogen sulfite

Systemtic Name: [3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propyl-phenyl] hydrogen sulfite Openeye Name: [3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propyl-phenyl] hydrogen sulfite CAS Name: sulfurous acid [3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propylphenyl] ester IUPAC Name: [3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propylphenyl] hydrogen sulfite Traditional Name: sulfurous acid [3-[(4-tert-butylphenoxy)methyl]-2-methyl-6-propyl-phenyl] ester Formula: C21H28O4S MolecularWeight: 376.50962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C=C1)COC2=CC=C(C=C2)C(C)(C)C)C)OS(=O)O

Isomeric SMILES

CCCC1=C(C(=C(C=C1)COC2=CC=C(C=C2)C(C)(C)C)C)OS(=O)O

InChI

InChI=1S/C21H28O4S/c1-6-7-16-8-9-17(15(2)20(16)25-26(22)23)14-24-19-12-10-18(11-13-19)21(3,4)5/h8-13H,6-7,14H2,1-5H3,(H,22,23)