ethyl 3-(bromomethyl)-5-methyl-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 3-(bromomethyl)-5-methyl-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-benzyl-3-(bromomethyl)-5-methyl-pyrazole-4-carboxylate CAS Name: 3-(bromomethyl)-5-methyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-(bromomethyl)-5-methylpyrazole-4-carboxylate Traditional Name: 1-benzyl-3-(bromomethyl)-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H17BrN2O2 MolecularWeight: 337.21168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1CBr)CC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1CBr)CC2=CC=CC=C2)C

InChI

InChI=1S/C15H17BrN2O2/c1-3-20-15(19)14-11(2)18(17-13(14)9-16)10-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3