ethyl 1-(2-chloranyl-4-methylsulfonyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-chloranyl-4-methylsulfonyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-chloro-4-methylsulfonyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate CAS Name: 1-(2-chloro-4-methylsulfonylphenyl)-5-cyclopropyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloro-4-methylsulfonylphenyl)-5-cyclopropylpyrazole-4-carboxylate Traditional Name: 1-(2-chloro-4-mesyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid ethyl ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)S(=O)(=O)C)Cl)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)S(=O)(=O)C)Cl)C3CC3

InChI

InChI=1S/C16H17ClN2O4S/c1-3-23-16(20)12-9-18-19(15(12)10-4-5-10)14-7-6-11(8-13(14)17)24(2,21)22/h6-10H,3-5H2,1-2H3