4-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]butanoyl chloride

Systemtic Name: 4-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]butanoyl chloride Openeye Name: 4-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]butanoyl chloride CAS Name: 4-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methyl-1-oxopropyl]amino]butanoyl chloride IUPAC Name: 4-[[3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methylpropanoyl]amino]butanoyl chloride Traditional Name: 4-[[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanoyl]amino]butyryl chloride Formula: C13H19ClN4O4 MolecularWeight: 330.76736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NCCCC(=O)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NCCCC(=O)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C13H19ClN4O4/c1-8(13(20)15-6-4-5-11(14)19)7-17-10(3)12(18(21)22)9(2)16-17/h8H,4-7H2,1-3H3,(H,15,20)