3-(6-bromanyl-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(6-bromanyl-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-1H-pyrazole-5-carboxylic acid Formula: C11H7BrN2O4 MolecularWeight: 311.08828

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3=NNC(=C3)C(=O)O)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3=NNC(=C3)C(=O)O)Br

InChI

InChI=1S/C11H7BrN2O4/c12-6-2-10-9(17-4-18-10)1-5(6)7-3-8(11(15)16)14-13-7/h1-3H,4H2,(H,13,14)(H,15,16)