(4-bromophenyl)methyl 2-oxidanylidene-2-(1,3,5-trimethylpyrazol-4-yl)ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-oxidanylidene-2-(1,3,5-trimethylpyrazol-4-yl)ethanoate Openeye Name: (4-bromophenyl)methyl 2-oxo-2-(1,3,5-trimethylpyrazol-4-yl)acetate CAS Name: 2-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-oxo-2-(1,3,5-trimethylpyrazol-4-yl)acetate Traditional Name: 2-keto-2-(1,3,5-trimethylpyrazol-4-yl)acetic acid (4-bromobenzyl) ester Formula: C15H15BrN2O3 MolecularWeight: 351.1952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)C(=O)OCC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)C(=O)OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H15BrN2O3/c1-9-13(10(2)18(3)17-9)14(19)15(20)21-8-11-4-6-12(16)7-5-11/h4-7H,8H2,1-3H3