ethyl 4-(4-nitropyrazol-1-yl)butanoate

Systemtic Name: ethyl 4-(4-nitropyrazol-1-yl)butanoate Openeye Name: ethyl 4-(4-nitropyrazol-1-yl)butanoate CAS Name: 4-(4-nitro-1-pyrazolyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-nitropyrazol-1-yl)butanoate Traditional Name: 4-(4-nitropyrazol-1-yl)butyric acid ethyl ester Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3O4/c1-2-16-9(13)4-3-5-11-7-8(6-10-11)12(14)15/h6-7H,2-5H2,1H3