ethyl 4-chloranylsulfonyl-1-methyl-5-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-chloranylsulfonyl-1-methyl-5-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-chlorosulfonyl-1-methyl-5-phenyl-pyrazole-3-carboxylate CAS Name: 4-chlorosulfonyl-1-methyl-5-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chlorosulfonyl-1-methyl-5-phenylpyrazole-3-carboxylate Traditional Name: 4-chlorosulfonyl-1-methyl-5-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1S(=O)(=O)Cl)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1S(=O)(=O)Cl)C2=CC=CC=C2)C

InChI

InChI=1S/C13H13ClN2O4S/c1-3-20-13(17)10-12(21(14,18)19)11(16(2)15-10)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3