[2-(hydroxymethyl)-5-oxidanylidene-4-propan-2-ylidene-oxolan-2-yl]methyl 4-[2-(4-methylphenyl)ethynyl]benzoate

Systemtic Name: [2-(hydroxymethyl)-5-oxidanylidene-4-propan-2-ylidene-oxolan-2-yl]methyl 4-[2-(4-methylphenyl)ethynyl]benzoate Openeye Name: [2-(hydroxymethyl)-4-isopropylidene-5-oxo-tetrahydrofuran-2-yl]methyl 4-[2-(p-tolyl)ethynyl]benzoate CAS Name: 4-[2-(4-methylphenyl)ethynyl]benzoic acid [2-(hydroxymethyl)-5-oxo-4-propan-2-ylidene-2-oxolanyl]methyl ester IUPAC Name: [2-(hydroxymethyl)-5-oxo-4-propan-2-ylideneoxolan-2-yl]methyl 4-[2-(4-methylphenyl)ethynyl]benzoate Traditional Name: 4-[2-(p-tolyl)ethynyl]benzoic acid (4-isopropylidene-5-keto-2-methylol-tetrahydrofuran-2-yl)methyl ester Formula: C25H24O5 MolecularWeight: 404.45506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OCC3(CC(=C(C)C)C(=O)O3)CO

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OCC3(CC(=C(C)C)C(=O)O3)CO

InChI

InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3