5-phenylpent-1-yn-3-yl benzoate

Systemtic Name: 5-phenylpent-1-yn-3-yl benzoate Openeye Name: 1-phenethylprop-2-ynyl benzoate CAS Name: benzoic acid 5-phenylpent-1-yn-3-yl ester IUPAC Name: 5-phenylpent-1-yn-3-yl benzoate Traditional Name: benzoic acid 1-phenethylprop-2-ynyl ester Formula: C18H16O2 MolecularWeight: 264.31844

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C#CC(CCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H16O2/c1-2-17(14-13-15-9-5-3-6-10-15)20-18(19)16-11-7-4-8-12-16/h1,3-12,17H,13-14H2