1-(1-adamantyl)-5-methyl-3,4-dinitro-pyrazole

Systemtic Name: 1-(1-adamantyl)-5-methyl-3,4-dinitro-pyrazole Openeye Name: 1-(1-adamantyl)-5-methyl-3,4-dinitro-pyrazole CAS Name: 1-(1-adamantyl)-5-methyl-3,4-dinitropyrazole IUPAC Name: 1-(1-adamantyl)-5-methyl-3,4-dinitropyrazole Traditional Name: 1-(1-adamantyl)-5-methyl-3,4-dinitro-pyrazole Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4/c1-8-12(17(19)20)13(18(21)22)15-16(8)14-5-9-2-10(6-14)4-11(3-9)7-14/h9-11H,2-7H2,1H3