2-[2-(3-bromanyl-4-propoxy-phenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-(3-bromanyl-4-propoxy-phenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-(3-bromo-4-propoxy-phenyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-bromo-4-propoxyphenyl)-4-thiazolyl]acetate IUPAC Name: 2-[2-(3-bromo-4-propoxyphenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(3-bromo-4-propoxy-phenyl)thiazol-4-yl]acetate Formula: C14H13BrNO3S- MolecularWeight: 355.22692

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)[O-])Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)[O-])Br

InChI

InChI=1S/C14H14BrNO3S/c1-2-5-19-12-4-3-9(6-11(12)15)14-16-10(8-20-14)7-13(17)18/h3-4,6,8H,2,5,7H2,1H3,(H,17,18)/p-1