4-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]-2-oxidanyl-benzoate

Systemtic Name: 4-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-[(E)-4-[2-(p-tolyl)phenyl]but-3-en-1-ynyl]benzoate CAS Name: 2-hydroxy-4-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]benzoate IUPAC Name: 2-hydroxy-4-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]benzoate Traditional Name: 2-hydroxy-4-[(E)-4-[2-(p-tolyl)phenyl]but-3-en-1-ynyl]benzoate Formula: C24H17O3- MolecularWeight: 353.38998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC=C2C=CC#CC3=CC(=C(C=C3)C(=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC=C2/C=C/C#CC3=CC(=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C24H18O3/c1-17-10-13-20(14-11-17)21-9-5-4-8-19(21)7-3-2-6-18-12-15-22(24(26)27)23(25)16-18/h3-5,7-16,25H,1H3,(H,26,27)/p-1/b7-3+