(3R,3aR,7aR)-7a-(2-bromanylprop-2-enyl)-3-methyl-3a,4-dihydro-3H-2-benzofuran-1,7-dione

Systemtic Name: (3R,3aR,7aR)-7a-(2-bromanylprop-2-enyl)-3-methyl-3a,4-dihydro-3H-2-benzofuran-1,7-dione Openeye Name: (3R,3aR,7aR)-7a-(2-bromoallyl)-3-methyl-3a,4-dihydro-3H-isobenzofuran-1,7-dione CAS Name: (3R,3aR,7aR)-7a-(2-bromoprop-2-enyl)-3-methyl-3a,4-dihydro-3H-isobenzofuran-1,7-dione IUPAC Name: (3R,3aR,7aR)-7a-(2-bromoprop-2-enyl)-3-methyl-3a,4-dihydro-3H-2-benzofuran-1,7-dione Traditional Name: (3R,3aR,7aR)-7a-(2-bromoallyl)-3-methyl-3a,4-dihydro-3H-isobenzofuran-1,7-quinone Formula: C12H13BrO3 MolecularWeight: 285.13382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrO3/c1-7(13)6-12-9(4-3-5-10(12)14)8(2)16-11(12)15/h3,5,8-9H,1,4,6H2,2H3/t8-,9+,12-/m1/s1