sodium 5-bromanyl-1-butan-2-yl-4-methyl-6-oxidanylidene-pyrimidin-2-olate

Systemtic Name: sodium 5-bromanyl-1-butan-2-yl-4-methyl-6-oxidanylidene-pyrimidin-2-olate Openeye Name: sodium 5-bromo-4-methyl-6-oxo-1-sec-butyl-pyrimidin-2-olate CAS Name: sodium 5-bromo-1-butan-2-yl-4-methyl-6-oxo-2-pyrimidinolate IUPAC Name: sodium 5-bromo-1-butan-2-yl-4-methyl-6-oxopyrimidin-2-olate Traditional Name: sodium 5-bromo-6-keto-4-methyl-1-sec-butyl-pyrimidin-2-olate Formula: C9H12BrN2NaO2 MolecularWeight: 283.09755

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=C(N=C1[O-])C)Br.[Na+]

Isomeric SMILES

CCC(C)N1C(=O)C(=C(N=C1[O-])C)Br.[Na+]

InChI

InChI=1S/C9H13BrN2O2.Na/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14;/h5H,4H2,1-3H3,(H,11,14);/q;+1/p-1