N-[1-(2-ethylpyrazol-3-yl)ethyl]-2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]ethanamide

Systemtic Name: N-[1-(2-ethylpyrazol-3-yl)ethyl]-2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]ethanamide Openeye Name: N-[1-(2-ethylpyrazol-3-yl)ethyl]-2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetamide CAS Name: N-[1-(2-ethyl-3-pyrazolyl)ethyl]-2-[3-(4-nitro-1-pyrazolyl)-1-adamantyl]acetamide IUPAC Name: N-[1-(2-ethylpyrazol-3-yl)ethyl]-2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetamide Traditional Name: N-[1-(2-ethylpyrazol-3-yl)ethyl]-2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetamide Formula: C22H30N6O3 MolecularWeight: 426.512

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5C=C(C=N5)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CC=N1)C(C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5C=C(C=N5)[N+](=O)[O-]

InChI

InChI=1S/C22H30N6O3/c1-3-26-19(4-5-23-26)15(2)25-20(29)11-21-7-16-6-17(8-21)10-22(9-16,14-21)27-13-18(12-24-27)28(30)31/h4-5,12-13,15-17H,3,6-11,14H2,1-2H3,(H,25,29)