1-phenylhex-1-yn-3-yl benzoate

Systemtic Name: 1-phenylhex-1-yn-3-yl benzoate Openeye Name: 1-(2-phenylethynyl)butyl benzoate CAS Name: benzoic acid 1-phenylhex-1-yn-3-yl ester IUPAC Name: 1-phenylhex-1-yn-3-yl benzoate Traditional Name: benzoic acid (3-phenyl-1-propyl-prop-2-ynyl) ester Formula: C19H18O2 MolecularWeight: 278.34502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#CC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(C#CC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H18O2/c1-2-9-18(15-14-16-10-5-3-6-11-16)21-19(20)17-12-7-4-8-13-17/h3-8,10-13,18H,2,9H2,1H3