1-(1-adamantyl)-N-butan-2-yl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-butan-2-yl-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-nitro-N-sec-butyl-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-butan-2-yl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-butan-2-yl-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-nitro-N-sec-butyl-pyrazole-3-carboxamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O3/c1-3-11(2)19-17(23)16-15(22(24)25)10-21(20-16)18-7-12-4-13(8-18)6-14(5-12)9-18/h10-14H,3-9H2,1-2H3,(H,19,23)