ethyl 3-[(2-bromophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-[(2-bromophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 3-[(2-bromophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxylate CAS Name: 3-[(2-bromophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-bromophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxylate Traditional Name: 3-(2-bromobenzyl)-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C14H15BrN2O2 MolecularWeight: 323.1851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1CC2=CC=CC=C2Br)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1CC2=CC=CC=C2Br)C

InChI

InChI=1S/C14H15BrN2O2/c1-3-19-14(18)13-9(2)16-17-12(13)8-10-6-4-5-7-11(10)15/h4-7H,3,8H2,1-2H3,(H,16,17)