2-tert-butyl-4a-iodanyl-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one

Systemtic Name: 2-tert-butyl-4a-iodanyl-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one Openeye Name: 2-tert-butyl-4a-iodo-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one CAS Name: 2-tert-butyl-4a-iodo-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one IUPAC Name: 2-tert-butyl-4a-iodo-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one Traditional Name: 2-tert-butyl-4a-iodo-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one Formula: C12H19IO3 MolecularWeight: 338.18193

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1OC2CCCCC2(C(=O)O1)I

Isomeric SMILES

CC(C)(C)C1OC2CCCCC2(C(=O)O1)I

InChI

InChI=1S/C12H19IO3/c1-11(2,3)10-15-8-6-4-5-7-12(8,13)9(14)16-10/h8,10H,4-7H2,1-3H3