ethyl 2-[4-(1,3-benzothiazol-2-yl)-5-bromanyl-2-ethoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-5-bromanyl-2-ethoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxy-phenoxy]acetate CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxyphenoxy]acetate Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxy-phenoxy]acetic acid ethyl ester Formula: C19H18BrNO4S MolecularWeight: 436.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3S2)Br)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3S2)Br)OCC(=O)OCC

InChI

InChI=1S/C19H18BrNO4S/c1-3-23-15-9-12(19-21-14-7-5-6-8-17(14)26-19)13(20)10-16(15)25-11-18(22)24-4-2/h5-10H,3-4,11H2,1-2H3