(4-bromanyl-2-fluoranyl-phenyl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C15H9BrFNO2S MolecularWeight: 366.204863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)OCC3=C(C=C(C=C3)Br)F)SC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)OCC3=C(C=C(C=C3)Br)F)SC=N2

InChI

InChI=1S/C15H9BrFNO2S/c16-11-3-1-10(12(17)6-11)7-20-15(19)9-2-4-13-14(5-9)21-8-18-13/h1-6,8H,7H2