prop-2-enyl 2-ethynylheptanoate

Systemtic Name: prop-2-enyl 2-ethynylheptanoate Openeye Name: allyl 2-ethynylheptanoate CAS Name: 2-ethynylheptanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-ethynylheptanoate Traditional Name: 2-amylbut-3-ynoic acid allyl ester Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#C)C(=O)OCC=C

Isomeric SMILES

CCCCCC(C#C)C(=O)OCC=C

InChI

InChI=1S/C12H18O2/c1-4-7-8-9-11(6-3)12(13)14-10-5-2/h3,5,11H,2,4,7-10H2,1H3