N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-2-(4-chloranylpyrazol-1-yl)butanamide

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-2-(4-chloranylpyrazol-1-yl)butanamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2-(4-chloropyrazol-1-yl)butanamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(4-chloro-1-pyrazolyl)butanamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(4-chloropyrazol-1-yl)butanamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-2-(4-chloropyrazol-1-yl)butyramide Formula: C20H18Cl2N4O4 MolecularWeight: 449.28732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)OC2=CC(=C(C=C2)Cl)C)[N+](=O)[O-])N3C=C(C=N3)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)OC2=CC(=C(C=C2)Cl)C)[N+](=O)[O-])N3C=C(C=N3)Cl

InChI

InChI=1S/C20H18Cl2N4O4/c1-3-19(25-11-13(21)10-23-25)20(27)24-14-7-15(26(28)29)9-17(8-14)30-16-4-5-18(22)12(2)6-16/h4-11,19H,3H2,1-2H3,(H,24,27)