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

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)propyl]-2-methyl-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-methyl-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)CN4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)CN4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C21H32N4O3/c1-4-18(21-9-15-6-16(10-21)8-17(7-15)11-21)22-20(26)13(2)12-24-14(3)5-19(23-24)25(27)28/h5,13,15-18H,4,6-12H2,1-3H3,(H,22,26)