1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-3-ethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-3-ethyl-pyrazole-4-carboxylic acid Openeye Name: 5-chloro-1-(1,1-dioxothiolan-3-yl)-3-ethyl-pyrazole-4-carboxylic acid CAS Name: 5-chloro-1-(1,1-dioxo-3-thiolanyl)-3-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-1-(1,1-dioxothiolan-3-yl)-3-ethylpyrazole-4-carboxylic acid Traditional Name: 5-chloro-1-(1,1-diketothiolan-3-yl)-3-ethyl-pyrazole-4-carboxylic acid Formula: C10H13ClN2O4S MolecularWeight: 292.73922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O)Cl)C2CCS(=O)(=O)C2

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O)Cl)C2CCS(=O)(=O)C2

InChI

InChI=1S/C10H13ClN2O4S/c1-2-7-8(10(14)15)9(11)13(12-7)6-3-4-18(16,17)5-6/h6H,2-5H2,1H3,(H,14,15)