methyl 4-chloranyl-1-nitro-pyrazole-3-carboxylate

Systemtic Name: methyl 4-chloranyl-1-nitro-pyrazole-3-carboxylate Openeye Name: methyl 4-chloro-1-nitro-pyrazole-3-carboxylate CAS Name: 4-chloro-1-nitro-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-chloro-1-nitropyrazole-3-carboxylate Traditional Name: 4-chloro-1-nitro-pyrazole-3-carboxylic acid methyl ester Formula: C5H4ClN3O4 MolecularWeight: 205.55596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=NN(C=C1Cl)[N+](=O)[O-]

InChI

InChI=1S/C5H4ClN3O4/c1-13-5(10)4-3(6)2-8(7-4)9(11)12/h2H,1H3