1-(1-adamantyl)-N-hexyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-hexyl-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-hexyl-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-hexyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-hexyl-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-hexyl-4-nitro-pyrazole-3-carboxamide Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCCNC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H30N4O3/c1-2-3-4-5-6-21-19(25)18-17(24(26)27)13-23(22-18)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,2-12H2,1H3,(H,21,25)