sodium (2R)-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]-5-oxidanylidene-thiophen-3-olate

Systemtic Name: sodium (2R)-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]-5-oxidanylidene-thiophen-3-olate Openeye Name: sodium (2R)-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]-5-oxo-thiophen-3-olate CAS Name: sodium (2R)-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]-5-oxo-3-thiophenolate IUPAC Name: sodium (2R)-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]-5-oxothiophen-3-olate Traditional Name: sodium (2R)-5-keto-2,4-dimethyl-2-[(1Z)-2-methylbuta-1,3-dienyl]thiophen-3-olate Formula: C11H13NaO2S MolecularWeight: 232.27449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(SC1=O)(C)C=C(C)C=C)[O-].[Na+]

Isomeric SMILES

CC1=C([C@@](SC1=O)(C)/C=C(/C)\C=C)[O-].[Na+]

InChI

InChI=1S/C11H14O2S.Na/c1-5-7(2)6-11(4)9(12)8(3)10(13)14-11;/h5-6,12H,1H2,2-4H3;/q;+1/p-1/b7-6-;/t11-;/m1./s1