methyl 1-(4-tert-butylphenyl)-3-methyl-3-oxidanyl-butane-1-sulfonate

Systemtic Name: methyl 1-(4-tert-butylphenyl)-3-methyl-3-oxidanyl-butane-1-sulfonate Openeye Name: methyl 1-(4-tert-butylphenyl)-3-hydroxy-3-methyl-butane-1-sulfonate CAS Name: 1-(4-tert-butylphenyl)-3-hydroxy-3-methyl-1-butanesulfonic acid IUPAC Name: methyl 1-(4-tert-butylphenyl)-3-hydroxy-3-methylbutane-1-sulfonate Traditional Name: 1-(4-tert-butylphenyl)-3-hydroxy-3-methyl-butane-1-sulfonic acid methyl ester Formula: C16H26O4S MolecularWeight: 314.44024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CC(C)(C)O)S(=O)(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CC(C)(C)O)S(=O)(=O)OC

InChI

InChI=1S/C16H26O4S/c1-15(2,3)13-9-7-12(8-10-13)14(11-16(4,5)17)21(18,19)20-6/h7-10,14,17H,11H2,1-6H3