dimethyl 4-oxidanyl-4-phenyl-hepta-2,5-diynedioate

Systemtic Name: dimethyl 4-oxidanyl-4-phenyl-hepta-2,5-diynedioate Openeye Name: dimethyl 4-hydroxy-4-phenyl-hepta-2,5-diynedioate CAS Name: 4-hydroxy-4-phenylhepta-2,5-diynedioic acid dimethyl ester IUPAC Name: dimethyl 4-hydroxy-4-phenylhepta-2,5-diynedioate Traditional Name: 4-hydroxy-4-phenyl-hepta-2,5-diynedioic acid dimethyl ester Formula: C15H12O5 MolecularWeight: 272.25278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12O5/c1-19-13(16)8-10-15(18,11-9-14(17)20-2)12-6-4-3-5-7-12/h3-7,18H,1-2H3