(2-methylpyrazol-3-yl) 2-chloranyl-3-(4,5-dihydro-1,2-oxazol-3-yl)-4-methylsulfonyl-benzoate

Systemtic Name: (2-methylpyrazol-3-yl) 2-chloranyl-3-(4,5-dihydro-1,2-oxazol-3-yl)-4-methylsulfonyl-benzoate Openeye Name: (2-methylpyrazol-3-yl) 2-chloro-3-(4,5-dihydroisoxazol-3-yl)-4-methylsulfonyl-benzoate CAS Name: 2-chloro-3-(4,5-dihydroisoxazol-3-yl)-4-methylsulfonylbenzoic acid (2-methyl-3-pyrazolyl) ester IUPAC Name: (2-methylpyrazol-3-yl) 2-chloro-3-(4,5-dihydro-1,2-oxazol-3-yl)-4-methylsulfonylbenzoate Traditional Name: 2-chloro-3-(2-isoxazolin-3-yl)-4-mesyl-benzoic acid (2-methylpyrazol-3-yl) ester Formula: C15H14ClN3O5S MolecularWeight: 383.80676

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)OC(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C3=NOCC3)Cl

Isomeric SMILES

CN1C(=CC=N1)OC(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C3=NOCC3)Cl

InChI

InChI=1S/C15H14ClN3O5S/c1-19-12(5-7-17-19)24-15(20)9-3-4-11(25(2,21)22)13(14(9)16)10-6-8-23-18-10/h3-5,7H,6,8H2,1-2H3