4-bromanyl-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C17H12BrN5O7 MolecularWeight: 478.21048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H12BrN5O7/c1-29-12-4-2-3-5-13(12)30-11-7-9(6-10(8-11)22(25)26)19-17(24)15-14(18)16(21-20-15)23(27)28/h2-8H,1H3,(H,19,24)(H,20,21)