1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methyl-but-3-en-1-ol

Systemtic Name: 1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methyl-but-3-en-1-ol Openeye Name: 1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methyl-but-3-en-1-ol CAS Name: 1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methyl-3-buten-1-ol IUPAC Name: 1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methylbut-3-en-1-ol Traditional Name: 1-(6-ethynyl-1,3-benzodioxol-5-yl)-3-methyl-but-3-en-1-ol Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(C1=CC2=C(C=C1C#C)OCO2)O

Isomeric SMILES

CC(=C)CC(C1=CC2=C(C=C1C#C)OCO2)O

InChI

InChI=1S/C14H14O3/c1-4-10-6-13-14(17-8-16-13)7-11(10)12(15)5-9(2)3/h1,6-7,12,15H,2,5,8H2,3H3