1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethyl-4-pyrazolyl)-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-3-carboxamide Formula: C20H26N6O3 MolecularWeight: 398.45884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H26N6O3/c1-11-17(12(2)24(3)22-11)21-19(27)18-16(26(28)29)10-25(23-18)20-7-13-4-14(8-20)6-15(5-13)9-20/h10,13-15H,4-9H2,1-3H3,(H,21,27)