2,7-dimethyloct-7-en-5-yn-4-yl 5-chloranylpentanoate

Systemtic Name: 2,7-dimethyloct-7-en-5-yn-4-yl 5-chloranylpentanoate Openeye Name: (1-isobutyl-4-methyl-pent-4-en-2-ynyl) 5-chloropentanoate CAS Name: 5-chloropentanoic acid 2,7-dimethyloct-7-en-5-yn-4-yl ester IUPAC Name: 2,7-dimethyloct-7-en-5-yn-4-yl 5-chloropentanoate Traditional Name: 5-chlorovaleric acid (1-isobutyl-4-methyl-pent-4-en-2-ynyl) ester Formula: C15H23ClO2 MolecularWeight: 270.79492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23ClO2/c1-12(2)8-9-14(11-13(3)4)18-15(17)7-5-6-10-16/h13-14H,1,5-7,10-11H2,2-4H3