1,3-benzoxazol-2-ylmethyl 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: 1,3-benzoxazol-2-ylmethyl 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxylic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C19H13ClFN3O3 MolecularWeight: 385.776223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=NC3=CC=CC=C3O2)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=NC3=CC=CC=C3O2)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H13ClFN3O3/c1-11-17(18(20)24(23-11)13-8-6-12(21)7-9-13)19(25)26-10-16-22-14-4-2-3-5-15(14)27-16/h2-9H,10H2,1H3