N-(4-bromophenyl)-4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-(4-bromophenyl)-4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(4-bromophenyl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(4-bromophenyl)-4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(4-bromophenyl)-4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(4-bromophenyl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C14H14BrClN4O3 MolecularWeight: 401.64296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H14BrClN4O3/c1-9-13(16)14(20(22)23)18-19(9)8-2-3-12(21)17-11-6-4-10(15)5-7-11/h4-7H,2-3,8H2,1H3,(H,17,21)