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

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C29H21ClN4O4 MolecularWeight: 524.95444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H21ClN4O4/c1-19-14-24(12-13-27(19)30)38-25-16-21(15-23(17-25)34(36)37)31-29(35)26-18-33(22-10-6-3-7-11-22)32-28(26)20-8-4-2-5-9-20/h2-18H,1H3,(H,31,35)