ethyl 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butanoate

Systemtic Name: ethyl 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butanoate Openeye Name: ethyl 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butanoate CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-3,5-dimethylpyrazol-1-yl)butanoate Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butyric acid ethyl ester Formula: C11H17ClN2O2 MolecularWeight: 244.71788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C(=C(C(=N1)C)Cl)C

Isomeric SMILES

CCC(C(=O)OCC)N1C(=C(C(=N1)C)Cl)C

InChI

InChI=1S/C11H17ClN2O2/c1-5-9(11(15)16-6-2)14-8(4)10(12)7(3)13-14/h9H,5-6H2,1-4H3