4-bromanyl-1-tert-butyl-3-methyl-pyrazole

Systemtic Name: 4-bromanyl-1-tert-butyl-3-methyl-pyrazole Openeye Name: 4-bromo-1-tert-butyl-3-methyl-pyrazole CAS Name: 4-bromo-1-tert-butyl-3-methylpyrazole IUPAC Name: 4-bromo-1-tert-butyl-3-methylpyrazole Traditional Name: 4-bromo-1-tert-butyl-3-methyl-pyrazole Formula: C8H13BrN2 MolecularWeight: 217.10622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)C(C)(C)C

Isomeric SMILES

CC1=NN(C=C1Br)C(C)(C)C

InChI

InChI=1S/C8H13BrN2/c1-6-7(9)5-11(10-6)8(2,3)4/h5H,1-4H3