3-azanyl-6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-1,2-benzoxazole-5-carboxylic acid

Systemtic Name: 3-azanyl-6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-1,2-benzoxazole-5-carboxylic acid Openeye Name: 3-amino-6-(4-bromo-2-chloro-anilino)-7-fluoro-1,2-benzoxazole-5-carboxylic acid CAS Name: 3-amino-6-(4-bromo-2-chloroanilino)-7-fluoro-1,2-benzoxazole-5-carboxylic acid IUPAC Name: 3-amino-6-(4-bromo-2-chloroanilino)-7-fluoro-1,2-benzoxazole-5-carboxylic acid Traditional Name: 3-amino-6-(4-bromo-2-chloro-anilino)-7-fluoro-indoxazene-5-carboxylic acid Formula: C14H8BrClFN3O3 MolecularWeight: 400.587023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)NC2=C(C=C3C(=C2F)ON=C3N)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)NC2=C(C=C3C(=C2F)ON=C3N)C(=O)O

InChI

InChI=1S/C14H8BrClFN3O3/c15-5-1-2-9(8(16)3-5)19-11-6(14(21)22)4-7-12(10(11)17)23-20-13(7)18/h1-4,19H,(H2,18,20)(H,21,22)