2,3,6-tris(chloranyl)-5-(3-nitrophenyl)benzoic acid

Systemtic Name: 2,3,6-tris(chloranyl)-5-(3-nitrophenyl)benzoic acid Openeye Name: 2,3,6-trichloro-5-(3-nitrophenyl)benzoic acid CAS Name: 2,3,6-trichloro-5-(3-nitrophenyl)benzoic acid IUPAC Name: 2,3,6-trichloro-5-(3-nitrophenyl)benzoic acid Traditional Name: 2,3,6-trichloro-5-(3-nitrophenyl)benzoic acid Formula: C13H6Cl3NO4 MolecularWeight: 346.55004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(C(=C2Cl)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(C(=C2Cl)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H6Cl3NO4/c14-9-5-8(11(15)10(12(9)16)13(18)19)6-2-1-3-7(4-6)17(20)21/h1-5H,(H,18,19)