ethyl 3,5-bis(3-oxidanylprop-1-ynyl)benzoate

Systemtic Name: ethyl 3,5-bis(3-oxidanylprop-1-ynyl)benzoate Openeye Name: ethyl 3,5-bis(3-hydroxyprop-1-ynyl)benzoate CAS Name: 3,5-bis(3-hydroxyprop-1-ynyl)benzoic acid ethyl ester IUPAC Name: ethyl 3,5-bis(3-hydroxyprop-1-ynyl)benzoate Traditional Name: 3,5-bis(3-hydroxyprop-1-ynyl)benzoic acid ethyl ester Formula: C15H14O4 MolecularWeight: 258.26926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C#CCO)C#CCO

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C#CCO)C#CCO

InChI

InChI=1S/C15H14O4/c1-2-19-15(18)14-10-12(5-3-7-16)9-13(11-14)6-4-8-17/h9-11,16-17H,2,7-8H2,1H3