1-(3-methoxyphenyl)penta-1,4-diyn-3-yl ethanoate

Systemtic Name: 1-(3-methoxyphenyl)penta-1,4-diyn-3-yl ethanoate Openeye Name: [1-ethynyl-3-(3-methoxyphenyl)prop-2-ynyl] acetate CAS Name: acetic acid 1-(3-methoxyphenyl)penta-1,4-diyn-3-yl ester IUPAC Name: 1-(3-methoxyphenyl)penta-1,4-diyn-3-yl acetate Traditional Name: acetic acid [1-ethynyl-3-(3-methoxyphenyl)prop-2-ynyl] ester Formula: C14H12O3 MolecularWeight: 228.24328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12O3/c1-4-13(17-11(2)15)9-8-12-6-5-7-14(10-12)16-3/h1,5-7,10,13H,2-3H3