ethyl 4-[4-nitro-3-(1-phenylpyrazol-4-yl)pyrazol-1-yl]butanoate

Systemtic Name: ethyl 4-[4-nitro-3-(1-phenylpyrazol-4-yl)pyrazol-1-yl]butanoate Openeye Name: ethyl 4-[4-nitro-3-(1-phenylpyrazol-4-yl)pyrazol-1-yl]butanoate CAS Name: 4-[4-nitro-3-(1-phenyl-4-pyrazolyl)-1-pyrazolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-nitro-3-(1-phenylpyrazol-4-yl)pyrazol-1-yl]butanoate Traditional Name: 4-[4-nitro-3-(1-phenylpyrazol-4-yl)pyrazol-1-yl]butyric acid ethyl ester Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C(=N1)C2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCN1C=C(C(=N1)C2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4/c1-2-27-17(24)9-6-10-21-13-16(23(25)26)18(20-21)14-11-19-22(12-14)15-7-4-3-5-8-15/h3-5,7-8,11-13H,2,6,9-10H2,1H3