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

Systemtic Name: 3-(4-chlorophenyl)-N-[3-(4-methylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[3-(4-methylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[3-(4-methylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[3-(4-methylphenoxy)-5-nitrophenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[3-(4-methylphenoxy)-5-nitro-phenyl]-1H-pyrazole-5-carboxamide Formula: C23H17ClN4O4 MolecularWeight: 448.85848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H17ClN4O4/c1-14-2-8-19(9-3-14)32-20-11-17(10-18(12-20)28(30)31)25-23(29)22-13-21(26-27-22)15-4-6-16(24)7-5-15/h2-13H,1H3,(H,25,29)(H,26,27)