ethyl 4-oxidanyl-3,5-bis(2-phenylethynyl)benzoate

Systemtic Name: ethyl 4-oxidanyl-3,5-bis(2-phenylethynyl)benzoate Openeye Name: ethyl 4-hydroxy-3,5-bis(2-phenylethynyl)benzoate CAS Name: 4-hydroxy-3,5-bis(2-phenylethynyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-3,5-bis(2-phenylethynyl)benzoate Traditional Name: 4-hydroxy-3,5-bis(2-phenylethynyl)benzoic acid ethyl ester Formula: C25H18O3 MolecularWeight: 366.40862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)C#CC2=CC=CC=C2)O)C#CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)C#CC2=CC=CC=C2)O)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H18O3/c1-2-28-25(27)23-17-21(15-13-19-9-5-3-6-10-19)24(26)22(18-23)16-14-20-11-7-4-8-12-20/h3-12,17-18,26H,2H2,1H3