4,5-bis(chloranyl)-6-(2-ethylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylic acid

Systemtic Name: 4,5-bis(chloranyl)-6-(2-ethylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylic acid Openeye Name: 4,5-dichloro-6-(2-ethylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid CAS Name: 4,5-dichloro-6-[(2-ethyl-3-pyrazolyl)-oxomethyl]-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 4,5-dichloro-6-(2-ethylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Traditional Name: 4,5-dichloro-6-(2-ethylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Formula: C14H10Cl2N2O5 MolecularWeight: 357.1456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)C2=CC3=C(C(=C2Cl)Cl)OC(O3)C(=O)O

Isomeric SMILES

CCN1C(=CC=N1)C(=O)C2=CC3=C(C(=C2Cl)Cl)OC(O3)C(=O)O

InChI

InChI=1S/C14H10Cl2N2O5/c1-2-18-7(3-4-17-18)11(19)6-5-8-12(10(16)9(6)15)23-14(22-8)13(20)21/h3-5,14H,2H2,1H3,(H,20,21)