N-(2-adamantyl)-2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(2-adamantyl)-2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(2-adamantyl)-2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: N-(2-adamantyl)-2-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(2-adamantyl)-2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: N-(2-adamantyl)-2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)acetamide Formula: C16H21ClN4O3 MolecularWeight: 352.81594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2C3CC4CC(C3)CC2C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2C3CC4CC(C3)CC2C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H21ClN4O3/c1-8-14(17)16(21(23)24)19-20(8)7-13(22)18-15-11-3-9-2-10(5-11)6-12(15)4-9/h9-12,15H,2-7H2,1H3,(H,18,22)