(3R,3aR,7R,7aR)-3-methyl-7-oxidanyl-7a-prop-2-ynyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one

Systemtic Name: (3R,3aR,7R,7aR)-3-methyl-7-oxidanyl-7a-prop-2-ynyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one Openeye Name: (3R,3aR,7R,7aR)-7-hydroxy-3-methyl-7a-prop-2-ynyl-3,3a,4,7-tetrahydroisobenzofuran-1-one CAS Name: (3R,3aR,7R,7aR)-7-hydroxy-3-methyl-7a-prop-2-ynyl-3,3a,4,7-tetrahydroisobenzofuran-1-one IUPAC Name: (3R,3aR,7R,7aR)-7-hydroxy-3-methyl-7a-prop-2-ynyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one Traditional Name: (3R,3aR,7R,7aR)-7-hydroxy-3-methyl-7a-propargyl-3,3a,4,7-tetrahydroisobenzofuran-1-one Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC=CC(C2(C(=O)O1)CC#C)O

Isomeric SMILES

C[C@@H]1[C@@H]2CC=C[C@H]([C@@]2(C(=O)O1)CC#C)O

InChI

InChI=1S/C12H14O3/c1-3-7-12-9(5-4-6-10(12)13)8(2)15-11(12)14/h1,4,6,8-10,13H,5,7H2,2H3/t8-,9+,10-,12-/m1/s1