(3R,4R,5S)-3-butyl-4-ethynyl-5-methyl-oxolan-2-one

Systemtic Name: (3R,4R,5S)-3-butyl-4-ethynyl-5-methyl-oxolan-2-one Openeye Name: (3R,4R,5S)-3-butyl-4-ethynyl-5-methyl-tetrahydrofuran-2-one CAS Name: (3R,4R,5S)-3-butyl-4-ethynyl-5-methyl-2-oxolanone IUPAC Name: (3R,4R,5S)-3-butyl-4-ethynyl-5-methyloxolan-2-one Traditional Name: (3R,4R,5S)-3-butyl-4-ethynyl-5-methyl-tetrahydrofuran-2-one Formula: C11H16O2 MolecularWeight: 180.24354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(C(OC1=O)C)C#C

Isomeric SMILES

CCCC[C@@H]1[C@@H]([C@@H](OC1=O)C)C#C

InChI

InChI=1S/C11H16O2/c1-4-6-7-10-9(5-2)8(3)13-11(10)12/h2,8-10H,4,6-7H2,1,3H3/t8-,9+,10+/m0/s1