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

Systemtic Name: N-[3-(4-acetamidophenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-acetamidophenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-(4-acetamidophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-acetamidophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-(4-acetamidophenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C31H25N5O5 MolecularWeight: 547.5607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C31H25N5O5/c1-20-29(30(22-9-5-3-6-10-22)34-35(20)25-11-7-4-8-12-25)31(38)33-24-17-26(36(39)40)19-28(18-24)41-27-15-13-23(14-16-27)32-21(2)37/h3-19H,1-2H3,(H,32,37)(H,33,38)