methyl 2,6-bis(chloranyl)-3-(3-ethyl-1-oxidanyl-pyrazol-4-yl)carbonyl-benzoate

Systemtic Name: methyl 2,6-bis(chloranyl)-3-(3-ethyl-1-oxidanyl-pyrazol-4-yl)carbonyl-benzoate Openeye Name: methyl 2,6-dichloro-3-(3-ethyl-1-hydroxy-pyrazole-4-carbonyl)benzoate CAS Name: 2,6-dichloro-3-[(3-ethyl-1-hydroxy-4-pyrazolyl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2,6-dichloro-3-(3-ethyl-1-hydroxypyrazole-4-carbonyl)benzoate Traditional Name: 2,6-dichloro-3-(3-ethyl-1-hydroxy-pyrazole-4-carbonyl)benzoic acid methyl ester Formula: C14H12Cl2N2O4 MolecularWeight: 343.16208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C=C1C(=O)C2=C(C(=C(C=C2)Cl)C(=O)OC)Cl)O

Isomeric SMILES

CCC1=NN(C=C1C(=O)C2=C(C(=C(C=C2)Cl)C(=O)OC)Cl)O

InChI

InChI=1S/C14H12Cl2N2O4/c1-3-10-8(6-18(21)17-10)13(19)7-4-5-9(15)11(12(7)16)14(20)22-2/h4-6,21H,3H2,1-2H3