N-(1-adamantylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(1-adamantylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(1-adamantylmethyl)-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(1-adamantylmethyl)-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(1-adamantylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC12CC3CC(C1)CC(C3)C2)N4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCC12CC3CC(C1)CC(C3)C2)N4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C19H28N4O3/c1-3-16(22-12(2)4-17(21-22)23(25)26)18(24)20-11-19-8-13-5-14(9-19)7-15(6-13)10-19/h4,13-16H,3,5-11H2,1-2H3,(H,20,24)