ethyl (3S)-2-(3-chloranylpyridin-2-yl)-5-oxidanylidene-pyrazolidine-3-carboxylate

Systemtic Name: ethyl (3S)-2-(3-chloranylpyridin-2-yl)-5-oxidanylidene-pyrazolidine-3-carboxylate Openeye Name: ethyl (3S)-2-(3-chloro-2-pyridyl)-5-oxo-pyrazolidine-3-carboxylate CAS Name: (3S)-2-(3-chloro-2-pyridinyl)-5-oxo-3-pyrazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-2-(3-chloropyridin-2-yl)-5-oxopyrazolidine-3-carboxylate Traditional Name: (3S)-2-(3-chloro-2-pyridyl)-5-keto-pyrazolidine-3-carboxylic acid ethyl ester Formula: C11H12ClN3O3 MolecularWeight: 269.68428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=O)NN1C2=C(C=CC=N2)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1CC(=O)NN1C2=C(C=CC=N2)Cl

InChI

InChI=1S/C11H12ClN3O3/c1-2-18-11(17)8-6-9(16)14-15(8)10-7(12)4-3-5-13-10/h3-5,8H,2,6H2,1H3,(H,14,16)/t8-/m0/s1