N-[3-nitro-5-(4-oxidanylphenoxy)phenyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-nitro-5-(4-oxidanylphenoxy)phenyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C28H20N4O5 MolecularWeight: 492.4822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)O)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)O)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H20N4O5/c33-23-11-13-24(14-12-23)37-25-16-20(15-22(17-25)32(35)36)29-28(34)26-18-31(21-9-5-2-6-10-21)30-27(26)19-7-3-1-4-8-19/h1-18,33H,(H,29,34)