(5-methyl-4-oxidanyl-4-propan-2-yl-hex-2-ynyl) ethanoate

Systemtic Name: (5-methyl-4-oxidanyl-4-propan-2-yl-hex-2-ynyl) ethanoate Openeye Name: (4-hydroxy-4-isopropyl-5-methyl-hex-2-ynyl) acetate CAS Name: acetic acid (4-hydroxy-5-methyl-4-propan-2-ylhex-2-ynyl) ester IUPAC Name: (4-hydroxy-5-methyl-4-propan-2-ylhex-2-ynyl) acetate Traditional Name: acetic acid (4-hydroxy-4-isopropyl-5-methyl-hex-2-ynyl) ester Formula: C12H20O3 MolecularWeight: 212.2854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CCOC(=O)C)(C(C)C)O

Isomeric SMILES

CC(C)C(C#CCOC(=O)C)(C(C)C)O

InChI

InChI=1S/C12H20O3/c1-9(2)12(14,10(3)4)7-6-8-15-11(5)13/h9-10,14H,8H2,1-5H3