4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanoic acid

Systemtic Name: 4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanoic acid Openeye Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butanoic acid CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)butanoic acid IUPAC Name: 4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)butanoic acid Traditional Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butyric acid Formula: C8H10ClN3O4 MolecularWeight: 247.6357

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10ClN3O4/c1-5-7(9)8(12(15)16)10-11(5)4-2-3-6(13)14/h2-4H2,1H3,(H,13,14)