N-[3-(4-methylphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-(4-methylphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-(4-methylphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-(4-methylphenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-(4-methylphenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-(4-methylphenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C17H13N5O6 MolecularWeight: 383.31502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O6/c1-10-2-4-13(5-3-10)28-14-7-11(6-12(8-14)21(24)25)18-17(23)15-9-16(20-19-15)22(26)27/h2-9H,1H3,(H,18,23)(H,19,20)