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

Systemtic Name: (3-methoxyphenyl)methyl 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylate Openeye Name: (3-methoxyphenyl)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 (3-methoxyphenyl)methyl ester IUPAC Name: (3-methoxyphenyl)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 m-anisyl ester Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O4/c1-12-18(20)13(2)22(21-12)10-16-7-8-17(26-16)19(23)25-11-14-5-4-6-15(9-14)24-3/h4-9H,10-11H2,1-3H3