4-(1,3-benzodioxol-5-yl)-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-1,3-thiazole-2-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)thiazole-2-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-2-thiazolecarboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-1,3-thiazole-2-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)thiazole-2-carboxylic acid Formula: C11H7NO4S MolecularWeight: 249.24258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7NO4S/c13-11(14)10-12-7(4-17-10)6-1-2-8-9(3-6)16-5-15-8/h1-4H,5H2,(H,13,14)