N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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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=CC(=NN3C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=NN3C)C)Cl

InChI

InChI=1S/C19H17ClN4O4/c1-11-6-15(4-5-17(11)20)28-16-9-13(8-14(10-16)24(26)27)21-19(25)18-7-12(2)22-23(18)3/h4-10H,1-3H3,(H,21,25)