(3S,5R)-5-iodanyl-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one

Systemtic Name: (3S,5R)-5-iodanyl-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one Openeye Name: (3S,5R)-5-iodo-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one CAS Name: (3S,5R)-5-iodo-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one IUPAC Name: (3S,5R)-5-iodo-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one Traditional Name: (3S,5R)-5-iodo-3-methyl-3,4,5,6-tetrahydro-1-benzoxocin-2-one Formula: C12H13IO2 MolecularWeight: 316.13489

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC2=CC=CC=C2OC1=O)I

Isomeric SMILES

C[C@H]1C[C@H](CC2=CC=CC=C2OC1=O)I

InChI

InChI=1S/C12H13IO2/c1-8-6-10(13)7-9-4-2-3-5-11(9)15-12(8)14/h2-5,8,10H,6-7H2,1H3/t8-,10+/m0/s1