5-(phenylcarbonyloxy)hex-3-yn-2-yl benzoate

Systemtic Name: 5-(phenylcarbonyloxy)hex-3-yn-2-yl benzoate Openeye Name: (4-benzoyloxy-1-methyl-pent-2-ynyl) benzoate CAS Name: benzoic acid 5-benzoyloxyhex-3-yn-2-yl ester IUPAC Name: 5-benzoyloxyhex-3-yn-2-yl benzoate Traditional Name: benzoic acid (4-benzoyloxy-1-methyl-pent-2-ynyl) ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC(C)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C#CC(C)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H18O4/c1-15(23-19(21)17-9-5-3-6-10-17)13-14-16(2)24-20(22)18-11-7-4-8-12-18/h3-12,15-16H,1-2H3