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

Systemtic Name: 4,5-bis(chloranyl)-6-(2-propylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylic acid Openeye Name: 4,5-dichloro-6-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid CAS Name: 4,5-dichloro-6-[oxo-(2-propyl-3-pyrazolyl)methyl]-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 4,5-dichloro-6-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Traditional Name: 4,5-dichloro-6-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Formula: C15H12Cl2N2O5 MolecularWeight: 371.17218

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC=N1)C(=O)C2=CC3=C(C(=C2Cl)Cl)OC(O3)C(=O)O

Isomeric SMILES

CCCN1C(=CC=N1)C(=O)C2=CC3=C(C(=C2Cl)Cl)OC(O3)C(=O)O

InChI

InChI=1S/C15H12Cl2N2O5/c1-2-5-19-8(3-4-18-19)12(20)7-6-9-13(11(17)10(7)16)24-15(23-9)14(21)22/h3-4,6,15H,2,5H2,1H3,(H,21,22)