sodium (1E,4E)-3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)penta-1,4-dien-1-olate

Systemtic Name: sodium (1E,4E)-3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)penta-1,4-dien-1-olate Openeye Name: sodium (1E,4E)-3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)penta-1,4-dien-1-olate CAS Name: sodium (1E,4E)-3-oxo-5-(2,6,6-trimethyl-1-cyclohexenyl)-1-penta-1,4-dienolate IUPAC Name: sodium (1E,4E)-3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)penta-1,4-dien-1-olate Traditional Name: sodium (1E,4E)-3-keto-5-(2,6,6-trimethylcyclohexen-1-yl)penta-1,4-dien-1-olate Formula: C14H19NaO2 MolecularWeight: 242.28923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=O)C=C[O-].[Na+]

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=O)/C=C/[O-].[Na+]

InChI

InChI=1S/C14H20O2.Na/c1-11-5-4-9-14(2,3)13(11)7-6-12(16)8-10-15;/h6-8,10,15H,4-5,9H2,1-3H3;/q;+1/p-1/b7-6+,10-8+;