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sodium 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-propanoate

sodium 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-propanoate

Systemtic Name:sodium 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-propanoate
Openeye Name:sodium 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-propanoate
CAS Name:sodium 2-[(3,5-ditert-butylphenyl)thio]-2-methylpropanoate
IUPAC Name:sodium 2-(3,5-ditert-butylphenyl)sulfanyl-2-methylpropanoate
Traditional Name:sodium 2-[(3,5-ditert-butylphenyl)thio]-2-methyl-propionate
Formula: C18H27NaO2S
MolecularWeight: 330.46055
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)SC(C)(C)C(=O)[O-])C(C)(C)C.[Na+]


Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)SC(C)(C)C(=O)[O-])C(C)(C)C.[Na+]


InChI

InChI=1S/C18H28O2S.Na/c1-16(2,3)12-9-13(17(4,5)6)11-14(10-12)21-18(7,8)15(19)20;/h9-11H,1-8H3,(H,19,20);/q;+1/p-1


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