5-(2-bromanyl-4,5-diethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(2-bromanyl-4,5-diethoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(2-bromo-4,5-diethoxy-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(2-bromo-4,5-diethoxyphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(2-bromo-4,5-diethoxyphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(2-bromo-4,5-diethoxy-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C13H15BrIN3O2 MolecularWeight: 452.08557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2=C(C(=NN2)N)I)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2=C(C(=NN2)N)I)Br)OCC

InChI

InChI=1S/C13H15BrIN3O2/c1-3-19-9-5-7(8(14)6-10(9)20-4-2)12-11(15)13(16)18-17-12/h5-6H,3-4H2,1-2H3,(H3,16,17,18)