4-oxidanyl-1-[2,4,6-tris(bromanyl)phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-oxidanyl-1-[2,4,6-tris(bromanyl)phenyl]pyrazole-3-carboxylic acid Openeye Name: 4-hydroxy-1-(2,4,6-tribromophenyl)pyrazole-3-carboxylic acid CAS Name: 4-hydroxy-1-(2,4,6-tribromophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-hydroxy-1-(2,4,6-tribromophenyl)pyrazole-3-carboxylic acid Traditional Name: 4-hydroxy-1-(2,4,6-tribromophenyl)pyrazole-3-carboxylic acid Formula: C10H5Br3N2O3 MolecularWeight: 440.8703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)N2C=C(C(=N2)C(=O)O)O)Br)Br

Isomeric SMILES

C1=C(C=C(C(=C1Br)N2C=C(C(=N2)C(=O)O)O)Br)Br

InChI

InChI=1S/C10H5Br3N2O3/c11-4-1-5(12)9(6(13)2-4)15-3-7(16)8(14-15)10(17)18/h1-3,16H,(H,17,18)