2,3,4,5-tetrakis(chloranyl)-6-(4-pyrrolidin-1-ylphenyl)carbonyl-benzoic acid

Systemtic Name: 2,3,4,5-tetrakis(chloranyl)-6-(4-pyrrolidin-1-ylphenyl)carbonyl-benzoic acid Openeye Name: 2,3,4,5-tetrachloro-6-(4-pyrrolidin-1-ylbenzoyl)benzoic acid CAS Name: 2,3,4,5-tetrachloro-6-[oxo-[4-(1-pyrrolidinyl)phenyl]methyl]benzoic acid IUPAC Name: 2,3,4,5-tetrachloro-6-(4-pyrrolidin-1-ylbenzoyl)benzoic acid Traditional Name: 2,3,4,5-tetrachloro-6-(4-pyrrolidinobenzoyl)benzoic acid Formula: C18H13Cl4NO3 MolecularWeight: 433.11272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=O)C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=O)C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H13Cl4NO3/c19-13-11(12(18(25)26)14(20)16(22)15(13)21)17(24)9-3-5-10(6-4-9)23-7-1-2-8-23/h3-6H,1-2,7-8H2,(H,25,26)