6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3-(oxolan-2-ylmethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3-(oxolan-2-ylmethyl)benzimidazole-5-carboxylic acid Openeye Name: 6-(4-bromo-2-chloro-anilino)-7-fluoro-3-(tetrahydrofuran-2-ylmethyl)benzimidazole-5-carboxylic acid CAS Name: 6-(4-bromo-2-chloroanilino)-7-fluoro-3-(2-oxolanylmethyl)-5-benzimidazolecarboxylic acid IUPAC Name: 6-(4-bromo-2-chloroanilino)-7-fluoro-3-(oxolan-2-ylmethyl)benzimidazole-5-carboxylic acid Traditional Name: 6-(4-bromo-2-chloro-anilino)-7-fluoro-3-(tetrahydrofurfuryl)benzimidazole-5-carboxylic acid Formula: C19H16BrClFN3O3 MolecularWeight: 468.704043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C=NC3=C2C=C(C(=C3F)NC4=C(C=C(C=C4)Br)Cl)C(=O)O

Isomeric SMILES

C1CC(OC1)CN2C=NC3=C2C=C(C(=C3F)NC4=C(C=C(C=C4)Br)Cl)C(=O)O

InChI

InChI=1S/C19H16BrClFN3O3/c20-10-3-4-14(13(21)6-10)24-17-12(19(26)27)7-15-18(16(17)22)23-9-25(15)8-11-2-1-5-28-11/h3-4,6-7,9,11,24H,1-2,5,8H2,(H,26,27)