N-(2-adamantyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C16H22N4O3/c1-8-14(20(22)23)15(19(2)18-8)16(21)17-13-11-4-9-3-10(6-11)7-12(13)5-9/h9-13H,3-7H2,1-2H3,(H,17,21)