4-bromanyl-1H-naphthalene-1,4-dicarboxylic acid

Systemtic Name: 4-bromanyl-1H-naphthalene-1,4-dicarboxylic acid Openeye Name: 4-bromo-1H-naphthalene-1,4-dicarboxylic acid CAS Name: 4-bromo-1H-naphthalene-1,4-dicarboxylic acid IUPAC Name: 4-bromo-1H-naphthalene-1,4-dicarboxylic acid Traditional Name: 4-bromo-1H-naphthalene-1,4-dicarboxylic acid Formula: C12H9BrO4 MolecularWeight: 297.10146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C=CC2(C(=O)O)Br)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C=CC2(C(=O)O)Br)C(=O)O

InChI

InChI=1S/C12H9BrO4/c13-12(11(16)17)6-5-8(10(14)15)7-3-1-2-4-9(7)12/h1-6,8H,(H,14,15)(H,16,17)