4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butane-1-sulfinate

Systemtic Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butane-1-sulfinate Openeye Name: 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butane-1-sulfinate CAS Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-butanesulfinate IUPAC Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butane-1-sulfinate Traditional Name: 4-(2,4-ditert-amylphenoxy)butane-1-sulfinate Formula: C20H33O3S- MolecularWeight: 353.53922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCS(=O)[O-])C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCS(=O)[O-])C(C)(C)CC

InChI

InChI=1S/C20H34O3S/c1-7-19(3,4)16-11-12-18(17(15-16)20(5,6)8-2)23-13-9-10-14-24(21)22/h11-12,15H,7-10,13-14H2,1-6H3,(H,21,22)/p-1