sodium 6-methyl-3-[2-(1-methylpyrrol-2-yl)ethanoyl]-2-oxidanylidene-pyran-4-olate

Systemtic Name: sodium 6-methyl-3-[2-(1-methylpyrrol-2-yl)ethanoyl]-2-oxidanylidene-pyran-4-olate Openeye Name: sodium 6-methyl-3-[2-(1-methylpyrrol-2-yl)acetyl]-2-oxo-pyran-4-olate CAS Name: sodium 6-methyl-3-[2-(1-methyl-2-pyrrolyl)-1-oxoethyl]-2-oxo-4-pyranolate IUPAC Name: sodium 6-methyl-3-[2-(1-methylpyrrol-2-yl)acetyl]-2-oxopyran-4-olate Traditional Name: sodium 2-keto-6-methyl-3-[2-(1-methylpyrrol-2-yl)acetyl]pyran-4-olate Formula: C13H12NNaO4 MolecularWeight: 269.22845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)O1)C(=O)CC2=CC=CN2C)[O-].[Na+]

Isomeric SMILES

CC1=CC(=C(C(=O)O1)C(=O)CC2=CC=CN2C)[O-].[Na+]

InChI

InChI=1S/C13H13NO4.Na/c1-8-6-10(15)12(13(17)18-8)11(16)7-9-4-3-5-14(9)2;/h3-6,15H,7H2,1-2H3;/q;+1/p-1