2-(3-bromanylphenoxy)ethyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: 2-(3-bromophenoxy)ethyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid 2-(3-bromophenoxy)ethyl ester Formula: C17H14BrNO4S MolecularWeight: 408.26636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)OCCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)OCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14BrNO4S/c18-12-4-3-5-13(10-12)21-8-9-22-16(20)11-24-17-19-14-6-1-2-7-15(14)23-17/h1-7,10H,8-9,11H2