1-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-2-phenyl-ethanolate

Systemtic Name: 1-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-2-phenyl-ethanolate Openeye Name: 1-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)-2-phenyl-ethanolate CAS Name: 1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-2-phenylethanolate IUPAC Name: 1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-2-phenylethanolate Traditional Name: 1-(2,6-diketo-4,4-dimethyl-cyclohexylidene)-2-phenyl-ethanolate Formula: C16H17O3- MolecularWeight: 257.30438

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(CC2=CC=CC=C2)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(CC2=CC=CC=C2)[O-])C(=O)C1)C

InChI

InChI=1S/C16H18O3/c1-16(2)9-13(18)15(14(19)10-16)12(17)8-11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3/p-1