1-(4-bromophenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 1-(4-bromophenyl)-4-oxo-cyclohexanecarboxylic acid CAS Name: 1-(4-bromophenyl)-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 1-(4-bromophenyl)-4-oxocyclohexane-1-carboxylic acid Traditional Name: 1-(4-bromophenyl)-4-keto-cyclohexanecarboxylic acid Formula: C13H13BrO3 MolecularWeight: 297.14452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1=O)(C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CC(CCC1=O)(C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C13H13BrO3/c14-10-3-1-9(2-4-10)13(12(16)17)7-5-11(15)6-8-13/h1-4H,5-8H2,(H,16,17)