(4-chlorophenyl)methyl 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate Openeye Name: (4-chlorophenyl)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 (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)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 (4-chlorobenzyl) ester Formula: C18H16BrClN2O3 MolecularWeight: 423.68824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OCC3=CC=C(C=C3)Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OCC3=CC=C(C=C3)Cl)C)Br

InChI

InChI=1S/C18H16BrClN2O3/c1-11-17(19)12(2)22(21-11)9-15-7-8-16(25-15)18(23)24-10-13-3-5-14(20)6-4-13/h3-8H,9-10H2,1-2H3