[5,7-bis(bromanyl)quinolin-8-yl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 3H-benzimidazole-5-carboxylate Openeye Name: (5,7-dibromo-8-quinolyl) 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid (5,7-dibromo-8-quinolyl) ester Formula: C17H9Br2N3O2 MolecularWeight: 447.08026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2Br)Br)OC(=O)C3=CC4=C(C=C3)N=CN4)N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2Br)Br)OC(=O)C3=CC4=C(C=C3)N=CN4)N=C1

InChI

InChI=1S/C17H9Br2N3O2/c18-11-7-12(19)16(15-10(11)2-1-5-20-15)24-17(23)9-3-4-13-14(6-9)22-8-21-13/h1-8H,(H,21,22)