dimethyl 4-phenyl-4-(phenylcarbonyloxy)hepta-2,5-diynedioate

Systemtic Name: dimethyl 4-phenyl-4-(phenylcarbonyloxy)hepta-2,5-diynedioate Openeye Name: dimethyl 4-benzoyloxy-4-phenyl-hepta-2,5-diynedioate CAS Name: 4-benzoyloxy-4-phenylhepta-2,5-diynedioic acid dimethyl ester IUPAC Name: dimethyl 4-benzoyloxy-4-phenylhepta-2,5-diynedioate Traditional Name: 4-benzoyloxy-4-phenyl-hepta-2,5-diynedioic acid dimethyl ester Formula: C22H16O6 MolecularWeight: 376.35884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16O6/c1-26-19(23)13-15-22(16-14-20(24)27-2,18-11-7-4-8-12-18)28-21(25)17-9-5-3-6-10-17/h3-12H,1-2H3