hexyl 5-nitro-1H-pyrazole-4-carboxylate

Systemtic Name: hexyl 5-nitro-1H-pyrazole-4-carboxylate Openeye Name: hexyl 5-nitro-1H-pyrazole-4-carboxylate CAS Name: 5-nitro-1H-pyrazole-4-carboxylic acid hexyl ester IUPAC Name: hexyl 5-nitro-1H-pyrazole-4-carboxylate Traditional Name: 5-nitro-1H-pyrazole-4-carboxylic acid hexyl ester Formula: C10H15N3O4 MolecularWeight: 241.2438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15N3O4/c1-2-3-4-5-6-17-10(14)8-7-11-12-9(8)13(15)16/h7H,2-6H2,1H3,(H,11,12)