4-[2-(4-butylphenyl)ethynyl]benzoate

Systemtic Name: 4-[2-(4-butylphenyl)ethynyl]benzoate Openeye Name: 4-[2-(4-butylphenyl)ethynyl]benzoate CAS Name: 4-[2-(4-butylphenyl)ethynyl]benzoate IUPAC Name: 4-[2-(4-butylphenyl)ethynyl]benzoate Traditional Name: 4-[2-(4-butylphenyl)ethynyl]benzoate Formula: C19H17O2- MolecularWeight: 277.33708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C19H18O2/c1-2-3-4-15-5-7-16(8-6-15)9-10-17-11-13-18(14-12-17)19(20)21/h5-8,11-14H,2-4H2,1H3,(H,20,21)/p-1