(2-chloranyl-6-fluoranyl-phenyl)methyl 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-2-furancarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H15BrClFN2O3 MolecularWeight: 441.678703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OCC3=C(C=CC=C3Cl)F)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OCC3=C(C=CC=C3Cl)F)C)Br

InChI

InChI=1S/C18H15BrClFN2O3/c1-10-17(19)11(2)23(22-10)8-12-6-7-16(26-12)18(24)25-9-13-14(20)4-3-5-15(13)21/h3-7H,8-9H2,1-2H3