methyl 3-ethanoyl-2,4-bis(oxidanylidene)-6-phenyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 3-ethanoyl-2,4-bis(oxidanylidene)-6-phenyl-cyclohexane-1-carboxylate Openeye Name: methyl 3-acetyl-2,4-dioxo-6-phenyl-cyclohexanecarboxylate CAS Name: 3-acetyl-2,4-dioxo-6-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-2,4-dioxo-6-phenylcyclohexane-1-carboxylate Traditional Name: 3-acetyl-2,4-diketo-6-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C16H16O5 MolecularWeight: 288.29524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)CC(C(C1=O)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1C(=O)CC(C(C1=O)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H16O5/c1-9(17)13-12(18)8-11(10-6-4-3-5-7-10)14(15(13)19)16(20)21-2/h3-7,11,13-14H,8H2,1-2H3