N-(1-adamantylmethyl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-(1-adamantylmethyl)-2-(3-methoxy-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(3-methoxy-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide Formula: C17H24N4O4 MolecularWeight: 348.39686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H24N4O4/c1-25-16-14(21(23)24)8-20(19-16)9-15(22)18-10-17-5-11-2-12(6-17)4-13(3-11)7-17/h8,11-13H,2-7,9-10H2,1H3,(H,18,22)