(4-bromanyl-2-fluoranyl-phenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H11BrFNO3S MolecularWeight: 396.230843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H11BrFNO3S/c17-11-6-5-10(12(18)7-11)8-21-15(20)9-23-16-19-13-3-1-2-4-14(13)22-16/h1-7H,8-9H2