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

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C31H26N4O4 MolecularWeight: 518.56254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C)C

InChI

InChI=1S/C31H26N4O4/c1-20-14-21(2)16-27(15-20)39-28-18-24(17-26(19-28)35(37)38)32-31(36)29-22(3)34(25-12-8-5-9-13-25)33-30(29)23-10-6-4-7-11-23/h4-19H,1-3H3,(H,32,36)