sodium 2-bromanyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate

Systemtic Name: sodium 2-bromanyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate Openeye Name: sodium 2-bromo-5,5-dimethyl-3-oxo-cyclohexen-1-olate CAS Name: sodium 2-bromo-5,5-dimethyl-3-oxo-1-cyclohexenolate IUPAC Name: sodium 2-bromo-5,5-dimethyl-3-oxocyclohexen-1-olate Traditional Name: sodium 2-bromo-3-keto-5,5-dimethyl-cyclohexen-1-olate Formula: C8H10BrNaO2 MolecularWeight: 241.05757

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)Br)[O-])C.[Na+]

Isomeric SMILES

CC1(CC(=C(C(=O)C1)Br)[O-])C.[Na+]

InChI

InChI=1S/C8H11BrO2.Na/c1-8(2)3-5(10)7(9)6(11)4-8;/h10H,3-4H2,1-2H3;/q;+1/p-1