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

Systemtic Name: ethyl 4,5-bis(chloranyl)-6-(2-pyridin-2-ylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylate Openeye Name: ethyl 4,5-dichloro-6-[2-(2-pyridyl)pyrazole-3-carbonyl]-1,3-benzodioxole-2-carboxylate CAS Name: 4,5-dichloro-6-[oxo-[2-(2-pyridinyl)-3-pyrazolyl]methyl]-1,3-benzodioxole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dichloro-6-(2-pyridin-2-ylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylate Traditional Name: 4,5-dichloro-6-[2-(2-pyridyl)pyrazole-3-carbonyl]-1,3-benzodioxole-2-carboxylic acid ethyl ester Formula: C19H13Cl2N3O5 MolecularWeight: 434.22962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1OC2=C(O1)C(=C(C(=C2)C(=O)C3=CC=NN3C4=CC=CC=N4)Cl)Cl

Isomeric SMILES

CCOC(=O)C1OC2=C(O1)C(=C(C(=C2)C(=O)C3=CC=NN3C4=CC=CC=N4)Cl)Cl

InChI

InChI=1S/C19H13Cl2N3O5/c1-2-27-18(26)19-28-12-9-10(14(20)15(21)17(12)29-19)16(25)11-6-8-23-24(11)13-5-3-4-7-22-13/h3-9,19H,2H2,1H3