3-bromanyl-2,2-diethyl-pentane-1,1,1-tricarboxylic acid

Systemtic Name: 3-bromanyl-2,2-diethyl-pentane-1,1,1-tricarboxylic acid Openeye Name: 3-bromo-2,2-diethyl-pentane-1,1,1-tricarboxylic acid CAS Name: 3-bromo-2,2-diethylpentane-1,1,1-tricarboxylic acid IUPAC Name: 3-bromo-2,2-diethylpentane-1,1,1-tricarboxylic acid Traditional Name: 3-bromo-2,2-diethyl-pentane-1,1,1-tricarboxylic acid Formula: C12H19BrO6 MolecularWeight: 339.17966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC)(CC)C(C(=O)O)(C(=O)O)C(=O)O)Br

Isomeric SMILES

CCC(C(CC)(CC)C(C(=O)O)(C(=O)O)C(=O)O)Br

InChI

InChI=1S/C12H19BrO6/c1-4-7(13)11(5-2,6-3)12(8(14)15,9(16)17)10(18)19/h7H,4-6H2,1-3H3,(H,14,15)(H,16,17)(H,18,19)