ethyl (2S)-2-(4-chloranyl-3-methyl-pyrazol-1-yl)butanoate

Systemtic Name: ethyl (2S)-2-(4-chloranyl-3-methyl-pyrazol-1-yl)butanoate Openeye Name: ethyl (2S)-2-(4-chloro-3-methyl-pyrazol-1-yl)butanoate CAS Name: (2S)-2-(4-chloro-3-methyl-1-pyrazolyl)butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(4-chloro-3-methylpyrazol-1-yl)butanoate Traditional Name: (2S)-2-(4-chloro-3-methyl-pyrazol-1-yl)butyric acid ethyl ester Formula: C10H15ClN2O2 MolecularWeight: 230.6913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C(=O)OCC)N1C=C(C(=N1)C)Cl

InChI

InChI=1S/C10H15ClN2O2/c1-4-9(10(14)15-5-2)13-6-8(11)7(3)12-13/h6,9H,4-5H2,1-3H3/t9-/m0/s1