1-[6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3H-benzimidazol-5-yl]-2-phenylmethoxy-ethanone

Systemtic Name: 1-[6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3H-benzimidazol-5-yl]-2-phenylmethoxy-ethanone Openeye Name: 2-benzyloxy-1-[6-(4-bromo-2-chloro-anilino)-7-fluoro-3H-benzimidazol-5-yl]ethanone CAS Name: 1-[6-(4-bromo-2-chloroanilino)-7-fluoro-3H-benzimidazol-5-yl]-2-phenylmethoxyethanone IUPAC Name: 1-[6-(4-bromo-2-chloroanilino)-7-fluoro-3H-benzimidazol-5-yl]-2-phenylmethoxyethanone Traditional Name: 2-benzoxy-1-[6-(4-bromo-2-chloro-anilino)-7-fluoro-3H-benzimidazol-5-yl]ethanone Formula: C22H16BrClFN3O2 MolecularWeight: 488.736743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(=O)C2=CC3=C(C(=C2NC4=C(C=C(C=C4)Br)Cl)F)N=CN3

Isomeric SMILES

C1=CC=C(C=C1)COCC(=O)C2=CC3=C(C(=C2NC4=C(C=C(C=C4)Br)Cl)F)N=CN3

InChI

InChI=1S/C22H16BrClFN3O2/c23-14-6-7-17(16(24)8-14)28-21-15(9-18-22(20(21)25)27-12-26-18)19(29)11-30-10-13-4-2-1-3-5-13/h1-9,12,28H,10-11H2,(H,26,27)