7a-(iodanylmethyl)-4,4-dimethyl-5-oxidanyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one

Systemtic Name: 7a-(iodanylmethyl)-4,4-dimethyl-5-oxidanyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one Openeye Name: 5-hydroxy-7a-(iodomethyl)-4,4-dimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one CAS Name: 5-hydroxy-7a-(iodomethyl)-4,4-dimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one IUPAC Name: 5-hydroxy-7a-(iodomethyl)-4,4-dimethyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one Traditional Name: 5-hydroxy-7a-(iodomethyl)-4,4-dimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one Formula: C11H17IO3 MolecularWeight: 324.15535

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC2(C1CC(=O)O2)CI)O)C

Isomeric SMILES

CC1(C(CCC2(C1CC(=O)O2)CI)O)C

InChI

InChI=1S/C11H17IO3/c1-10(2)7-5-9(14)15-11(7,6-12)4-3-8(10)13/h7-8,13H,3-6H2,1-2H3