[(E)-(5,5-diethanoylcyclohex-2-en-1-ylidene)methyl] benzoate

Systemtic Name: [(E)-(5,5-diethanoylcyclohex-2-en-1-ylidene)methyl] benzoate Openeye Name: [(E)-(5,5-diacetylcyclohex-2-en-1-ylidene)methyl] benzoate CAS Name: benzoic acid [(E)-(5,5-diacetyl-1-cyclohex-2-enylidene)methyl] ester IUPAC Name: [(E)-(5,5-diacetylcyclohex-2-en-1-ylidene)methyl] benzoate Traditional Name: benzoic acid [(E)-(5,5-diacetylcyclohex-2-en-1-ylidene)methyl] ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC=CC(=COC(=O)C2=CC=CC=C2)C1)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H18O4/c1-13(19)18(14(2)20)10-6-7-15(11-18)12-22-17(21)16-8-4-3-5-9-16/h3-9,12H,10-11H2,1-2H3/b15-12-