5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-pyrazole-4-carbaldehyde

Systemtic Name: 5-(2-bromanyl-4-methyl-phenoxy)-1,3-dimethyl-pyrazole-4-carbaldehyde Openeye Name: 5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-pyrazole-4-carbaldehyde CAS Name: 5-(2-bromo-4-methylphenoxy)-1,3-dimethyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-(2-bromo-4-methylphenoxy)-1,3-dimethylpyrazole-4-carbaldehyde Traditional Name: 5-(2-bromo-4-methyl-phenoxy)-1,3-dimethyl-pyrazole-4-carbaldehyde Formula: C13H13BrN2O2 MolecularWeight: 309.15852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C(=NN2C)C)C=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C(=NN2C)C)C=O)Br

InChI

InChI=1S/C13H13BrN2O2/c1-8-4-5-12(11(14)6-8)18-13-10(7-17)9(2)15-16(13)3/h4-7H,1-3H3