2-[4-(6-bromanyl-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(6-bromanyl-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(6-bromo-1,3-benzodioxol-5-yl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(6-bromo-1,3-benzodioxol-5-yl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(6-bromo-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(6-bromo-1,3-benzodioxol-5-yl)thiazol-2-yl]acetic acid Formula: C12H8BrNO4S MolecularWeight: 342.16522

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3=CSC(=N3)CC(=O)O)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3=CSC(=N3)CC(=O)O)Br

InChI

InChI=1S/C12H8BrNO4S/c13-7-2-10-9(17-5-18-10)1-6(7)8-4-19-11(14-8)3-12(15)16/h1-2,4H,3,5H2,(H,15,16)