1-(1-adamantyl)-3-[1-(1-adamantyl)pyrazol-4-yl]-4-nitro-pyrazole

Systemtic Name: 1-(1-adamantyl)-3-[1-(1-adamantyl)pyrazol-4-yl]-4-nitro-pyrazole Openeye Name: 1-(1-adamantyl)-3-[1-(1-adamantyl)pyrazol-4-yl]-4-nitro-pyrazole CAS Name: 1-(1-adamantyl)-3-[1-(1-adamantyl)-4-pyrazolyl]-4-nitropyrazole IUPAC Name: 1-(1-adamantyl)-3-[1-(1-adamantyl)pyrazol-4-yl]-4-nitropyrazole Traditional Name: 1-(1-adamantyl)-3-[1-(1-adamantyl)pyrazol-4-yl]-4-nitro-pyrazole Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C=N4)C5=NN(C=C5[N+](=O)[O-])C67CC8CC(C6)CC(C8)C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C=N4)C5=NN(C=C5[N+](=O)[O-])C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C26H33N5O2/c32-31(33)23-15-30(26-10-19-4-20(11-26)6-21(5-19)12-26)28-24(23)22-13-27-29(14-22)25-7-16-1-17(8-25)3-18(2-16)9-25/h13-21H,1-12H2