sodium (2S)-2-[(2S)-butan-2-yl]-4-ethanoyl-3-oxidanylidene-1,2-dihydropyrrol-5-olate

Systemtic Name: sodium (2S)-2-[(2S)-butan-2-yl]-4-ethanoyl-3-oxidanylidene-1,2-dihydropyrrol-5-olate Openeye Name: sodium (2S)-4-acetyl-2-[(1S)-1-methylpropyl]-3-oxo-1,2-dihydropyrrol-5-olate CAS Name: sodium (2S)-4-acetyl-2-[(2S)-butan-2-yl]-3-oxo-1,2-dihydropyrrol-5-olate IUPAC Name: sodium (2S)-4-acetyl-2-[(2S)-butan-2-yl]-3-oxo-1,2-dihydropyrrol-5-olate Traditional Name: sodium (5S)-3-acetyl-4-keto-5-[(1S)-1-methylpropyl]-2-pyrrolin-2-olate Formula: C10H14NNaO3 MolecularWeight: 219.21283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)C(=C(N1)[O-])C(=O)C.[Na+]

Isomeric SMILES

CC[C@H](C)[C@H]1C(=O)C(=C(N1)[O-])C(=O)C.[Na+]

InChI

InChI=1S/C10H15NO3.Na/c1-4-5(2)8-9(13)7(6(3)12)10(14)11-8;/h5,8,11,14H,4H2,1-3H3;/q;+1/p-1/t5-,8-;/m0./s1