N-[2,6-bis(chloranyl)phenyl]-4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[2,6-bis(chloranyl)phenyl]-4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-(2,6-dichlorophenyl)butanamide CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-(2,6-dichlorophenyl)butanamide IUPAC Name: 4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-(2,6-dichlorophenyl)butanamide Traditional Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-(2,6-dichlorophenyl)butyramide Formula: C14H13Cl3N4O3 MolecularWeight: 391.63702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13Cl3N4O3/c1-8-12(17)14(21(23)24)19-20(8)7-3-6-11(22)18-13-9(15)4-2-5-10(13)16/h2,4-5H,3,6-7H2,1H3,(H,18,22)