phenyl-[(2S)-2,4,4-trimethyl-6-oxidanylidene-cyclohexylidene]methanolate

Systemtic Name: phenyl-[(2S)-2,4,4-trimethyl-6-oxidanylidene-cyclohexylidene]methanolate Openeye Name: phenyl-[(2S)-2,4,4-trimethyl-6-oxo-cyclohexylidene]methanolate CAS Name: phenyl-[(2S)-2,4,4-trimethyl-6-oxocyclohexylidene]methanolate IUPAC Name: phenyl-[(2S)-2,4,4-trimethyl-6-oxocyclohexylidene]methanolate Traditional Name: [(6S)-2-keto-4,4,6-trimethyl-cyclohexylidene]-phenyl-methanolate Formula: C16H19O2- MolecularWeight: 243.32086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(=O)C1=C(C2=CC=CC=C2)[O-])(C)C

Isomeric SMILES

C[C@H]1CC(CC(=O)C1=C(C2=CC=CC=C2)[O-])(C)C

InChI

InChI=1S/C16H20O2/c1-11-9-16(2,3)10-13(17)14(11)15(18)12-7-5-4-6-8-12/h4-8,11,18H,9-10H2,1-3H3/p-1/t11-/m0/s1