2-ethynyl-4-methyl-pentane-1,2,5-triol

Systemtic Name: 2-ethynyl-4-methyl-pentane-1,2,5-triol Openeye Name: 2-ethynyl-4-methyl-pentane-1,2,5-triol CAS Name: 2-ethynyl-4-methylpentane-1,2,5-triol IUPAC Name: 2-ethynyl-4-methylpentane-1,2,5-triol Traditional Name: 2-ethynyl-4-methyl-pentane-1,2,5-triol Formula: C8H14O3 MolecularWeight: 158.19496

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CO)(C#C)O)CO

Isomeric SMILES

CC(CC(CO)(C#C)O)CO

InChI

InChI=1S/C8H14O3/c1-3-8(11,6-10)4-7(2)5-9/h1,7,9-11H,4-6H2,2H3