hex-4-yn-3-yl 5-chloranylpentanoate

Systemtic Name: hex-4-yn-3-yl 5-chloranylpentanoate Openeye Name: 1-ethylbut-2-ynyl 5-chloropentanoate CAS Name: 5-chloropentanoic acid hex-4-yn-3-yl ester IUPAC Name: hex-4-yn-3-yl 5-chloropentanoate Traditional Name: 5-chlorovaleric acid 1-ethylbut-2-ynyl ester Formula: C11H17ClO2 MolecularWeight: 216.70448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC)OC(=O)CCCCCl

Isomeric SMILES

CCC(C#CC)OC(=O)CCCCCl

InChI

InChI=1S/C11H17ClO2/c1-3-7-10(4-2)14-11(13)8-5-6-9-12/h10H,4-6,8-9H2,1-2H3