(3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyl-oxolan-2-one

Systemtic Name: (3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyl-oxolan-2-one Openeye Name: (3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyl-tetrahydrofuran-2-one CAS Name: (3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyl-2-oxolanone IUPAC Name: (3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyloxolan-2-one Traditional Name: (3S,5R)-5-(4-bromophenyl)-3-ethyl-5-methyl-tetrahydrofuran-2-one Formula: C13H15BrO2 MolecularWeight: 283.161

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(OC1=O)(C)C2=CC=C(C=C2)Br

Isomeric SMILES

CC[C@H]1C[C@](OC1=O)(C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H15BrO2/c1-3-9-8-13(2,16-12(9)15)10-4-6-11(14)7-5-10/h4-7,9H,3,8H2,1-2H3/t9-,13+/m0/s1