4-chloranyl-5-nitro-1-propyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-5-nitro-1-propyl-pyrazole-3-carboxylic acid Openeye Name: 4-chloro-5-nitro-1-propyl-pyrazole-3-carboxylic acid CAS Name: 4-chloro-5-nitro-1-propyl-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-5-nitro-1-propylpyrazole-3-carboxylic acid Traditional Name: 4-chloro-5-nitro-1-propyl-pyrazole-3-carboxylic acid Formula: C7H8ClN3O4 MolecularWeight: 233.60912

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=C(C(=N1)C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C7H8ClN3O4/c1-2-3-10-6(11(14)15)4(8)5(9-10)7(12)13/h2-3H2,1H3,(H,12,13)