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

Systemtic Name: N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C18H14Cl2N4O4 MolecularWeight: 421.23416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC(=CC(=C2)OC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC(=CC(=C2)OC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C18H14Cl2N4O4/c1-10-5-16(23(2)22-10)18(25)21-12-7-13(24(26)27)9-14(8-12)28-17-4-3-11(19)6-15(17)20/h3-9H,1-2H3,(H,21,25)