methyl 2-(1-phenylhept-1-yn-3-yloxy)ethanoate

Systemtic Name: methyl 2-(1-phenylhept-1-yn-3-yloxy)ethanoate Openeye Name: methyl 2-[1-(2-phenylethynyl)pentoxy]acetate CAS Name: 2-(1-phenylhept-1-yn-3-yloxy)acetic acid methyl ester IUPAC Name: methyl 2-(1-phenylhept-1-yn-3-yloxy)acetate Traditional Name: 2-(1-butyl-3-phenyl-prop-2-ynoxy)acetic acid methyl ester Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C#CC1=CC=CC=C1)OCC(=O)OC

Isomeric SMILES

CCCCC(C#CC1=CC=CC=C1)OCC(=O)OC

InChI

InChI=1S/C16H20O3/c1-3-4-10-15(19-13-16(17)18-2)12-11-14-8-6-5-7-9-14/h5-9,15H,3-4,10,13H2,1-2H3