(3S,6R)-3-iodanyl-2,2-dimethyl-6-phenyl-oxane

Systemtic Name: (3S,6R)-3-iodanyl-2,2-dimethyl-6-phenyl-oxane Openeye Name: (3S,6R)-3-iodo-2,2-dimethyl-6-phenyl-tetrahydropyran CAS Name: (3S,6R)-3-iodo-2,2-dimethyl-6-phenyloxane IUPAC Name: (3S,6R)-3-iodo-2,2-dimethyl-6-phenyloxane Traditional Name: (3S,6R)-3-iodo-2,2-dimethyl-6-phenyl-tetrahydropyran Formula: C13H17IO MolecularWeight: 316.17795

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC(O1)C2=CC=CC=C2)I)C

Isomeric SMILES

CC1([C@H](CC[C@@H](O1)C2=CC=CC=C2)I)C

InChI

InChI=1S/C13H17IO/c1-13(2)12(14)9-8-11(15-13)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3/t11-,12+/m1/s1