sodium 6-methyl-2-oxidanylidene-3-(2-thiophen-2-ylethanoyl)pyran-4-olate

Systemtic Name: sodium 6-methyl-2-oxidanylidene-3-(2-thiophen-2-ylethanoyl)pyran-4-olate Openeye Name: sodium 6-methyl-2-oxo-3-[2-(2-thienyl)acetyl]pyran-4-olate CAS Name: sodium 6-methyl-2-oxo-3-(1-oxo-2-thiophen-2-ylethyl)-4-pyranolate IUPAC Name: sodium 6-methyl-2-oxo-3-(2-thiophen-2-ylacetyl)pyran-4-olate Traditional Name: sodium 2-keto-6-methyl-3-[2-(2-thienyl)acetyl]pyran-4-olate Formula: C12H9NaO4S MolecularWeight: 272.25223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)O1)C(=O)CC2=CC=CS2)[O-].[Na+]

Isomeric SMILES

CC1=CC(=C(C(=O)O1)C(=O)CC2=CC=CS2)[O-].[Na+]

InChI

InChI=1S/C12H10O4S.Na/c1-7-5-9(13)11(12(15)16-7)10(14)6-8-3-2-4-17-8;/h2-5,13H,6H2,1H3;/q;+1/p-1