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

Systemtic Name: ethyl 4-[4-nitro-3-[1-(4-nitrophenyl)pyrazol-4-yl]pyrazol-1-yl]butanoate Openeye Name: ethyl 4-[4-nitro-3-[1-(4-nitrophenyl)pyrazol-4-yl]pyrazol-1-yl]butanoate CAS Name: 4-[4-nitro-3-[1-(4-nitrophenyl)-4-pyrazolyl]-1-pyrazolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-nitro-3-[1-(4-nitrophenyl)pyrazol-4-yl]pyrazol-1-yl]butanoate Traditional Name: 4-[4-nitro-3-[1-(4-nitrophenyl)pyrazol-4-yl]pyrazol-1-yl]butyric acid ethyl ester Formula: C18H18N6O6 MolecularWeight: 414.37212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O6/c1-2-30-17(25)4-3-9-21-12-16(24(28)29)18(20-21)13-10-19-22(11-13)14-5-7-15(8-6-14)23(26)27/h5-8,10-12H,2-4,9H2,1H3