3-methylpent-1-yn-3-yl pentanoate

Systemtic Name: 3-methylpent-1-yn-3-yl pentanoate Openeye Name: (1-ethyl-1-methyl-prop-2-ynyl) pentanoate CAS Name: pentanoic acid 3-methylpent-1-yn-3-yl ester IUPAC Name: 3-methylpent-1-yn-3-yl pentanoate Traditional Name: valeric acid (1-ethyl-1-methyl-prop-2-ynyl) ester Formula: C11H18O2 MolecularWeight: 182.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C)(CC)C#C

Isomeric SMILES

CCCCC(=O)OC(C)(CC)C#C

InChI

InChI=1S/C11H18O2/c1-5-8-9-10(12)13-11(4,6-2)7-3/h2H,5,7-9H2,1,3-4H3