N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C26H24N4O5 MolecularWeight: 472.49256

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=NN(C=C3)COC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=CC=C4)C)C

InChI

InChI=1S/C26H24N4O5/c1-17-11-18(2)19(3)25(12-17)35-23-14-20(13-21(15-23)30(32)33)27-26(31)24-9-10-29(28-24)16-34-22-7-5-4-6-8-22/h4-15H,16H2,1-3H3,(H,27,31)