4-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]butanoyl chloride

Systemtic Name: 4-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]butanoyl chloride Openeye Name: 4-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]butanoyl chloride CAS Name: 4-[[2-methyl-3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]butanoyl chloride IUPAC Name: 4-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]butanoyl chloride Traditional Name: 4-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]butyryl chloride Formula: C11H15ClN4O4 MolecularWeight: 302.7142

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCCC(=O)Cl

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCCC(=O)Cl

InChI

InChI=1S/C11H15ClN4O4/c1-8(11(18)13-4-2-3-10(12)17)6-15-7-9(5-14-15)16(19)20/h5,7-8H,2-4,6H2,1H3,(H,13,18)