5-bromanyl-6-methoxy-4,4-dimethyl-oxan-2-one

Systemtic Name: 5-bromanyl-6-methoxy-4,4-dimethyl-oxan-2-one Openeye Name: 5-bromo-6-methoxy-4,4-dimethyl-tetrahydropyran-2-one CAS Name: 5-bromo-6-methoxy-4,4-dimethyl-2-oxanone IUPAC Name: 5-bromo-6-methoxy-4,4-dimethyloxan-2-one Traditional Name: 5-bromo-6-methoxy-4,4-dimethyl-tetrahydropyran-2-one Formula: C8H13BrO3 MolecularWeight: 237.09102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)OC(C1Br)OC)C

Isomeric SMILES

CC1(CC(=O)OC(C1Br)OC)C

InChI

InChI=1S/C8H13BrO3/c1-8(2)4-5(10)12-7(11-3)6(8)9/h6-7H,4H2,1-3H3