N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C20H30N4O3 MolecularWeight: 374.4772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C20H30N4O3/c1-4-17(20-9-14-6-15(10-20)8-16(7-14)11-20)21-19(25)13(3)23-12(2)5-18(22-23)24(26)27/h5,13-17H,4,6-11H2,1-3H3,(H,21,25)