1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-4-nitro-pyrazole-3-carboxamide Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=NN(C=C4[N+](=O)[O-])C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=NN(C=C4[N+](=O)[O-])C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C27H38N4O3/c1-2-23(26-9-16-3-17(10-26)5-18(4-16)11-26)28-25(32)24-22(31(33)34)15-30(29-24)27-12-19-6-20(13-27)8-21(7-19)14-27/h15-21,23H,2-14H2,1H3,(H,28,32)