[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: [(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: [(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid [(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid [(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] ester Formula: C16H15ClN4O3 MolecularWeight: 346.7683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC(C)C2=NN=C(O2)C3=CC=CC=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O[C@@H](C)C2=NN=C(O2)C3=CC=CC=C3)Cl)C

InChI

InChI=1S/C16H15ClN4O3/c1-9-12(13(17)21(3)20-9)16(22)23-10(2)14-18-19-15(24-14)11-7-5-4-6-8-11/h4-8,10H,1-3H3/t10-/m0/s1