3-methylpent-1-yn-3-yl 2-phenylethanoate

Systemtic Name: 3-methylpent-1-yn-3-yl 2-phenylethanoate Openeye Name: (1-ethyl-1-methyl-prop-2-ynyl) 2-phenylacetate CAS Name: 2-phenylacetic acid 3-methylpent-1-yn-3-yl ester IUPAC Name: 3-methylpent-1-yn-3-yl 2-phenylacetate Traditional Name: 2-phenylacetic acid (1-ethyl-1-methyl-prop-2-ynyl) ester Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O2/c1-4-14(3,5-2)16-13(15)11-12-9-7-6-8-10-12/h1,6-10H,5,11H2,2-3H3