ethyl 4,5-bis(chloranyl)-6-(2-methylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylate

Systemtic Name: ethyl 4,5-bis(chloranyl)-6-(2-methylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylate Openeye Name: ethyl 4,5-dichloro-6-(2-methylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylate CAS Name: 4,5-dichloro-6-[(2-methyl-3-pyrazolyl)-oxomethyl]-1,3-benzodioxole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dichloro-6-(2-methylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylate Traditional Name: 4,5-dichloro-6-(2-methylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid ethyl ester Formula: C15H12Cl2N2O5 MolecularWeight: 371.17218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1OC2=C(O1)C(=C(C(=C2)C(=O)C3=CC=NN3C)Cl)Cl

Isomeric SMILES

CCOC(=O)C1OC2=C(O1)C(=C(C(=C2)C(=O)C3=CC=NN3C)Cl)Cl

InChI

InChI=1S/C15H12Cl2N2O5/c1-3-22-14(21)15-23-9-6-7(10(16)11(17)13(9)24-15)12(20)8-4-5-18-19(8)2/h4-6,15H,3H2,1-2H3