1-[(2-chloranylphenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 1-[(2-chloranylphenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid Openeye Name: 1-[(2-chlorophenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid CAS Name: 1-[(2-chlorophenoxy)methyl]-4-nitro-3-pyrazolecarboxylic acid IUPAC Name: 1-[(2-chlorophenoxy)methyl]-4-nitropyrazole-3-carboxylic acid Traditional Name: 1-[(2-chlorophenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid Formula: C11H8ClN3O5 MolecularWeight: 297.65132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCN2C=C(C(=N2)C(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCN2C=C(C(=N2)C(=O)O)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H8ClN3O5/c12-7-3-1-2-4-9(7)20-6-14-5-8(15(18)19)10(13-14)11(16)17/h1-5H,6H2,(H,16,17)