morpholin-4-yl-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone

Systemtic Name: morpholin-4-yl-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone Openeye Name: morpholino-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone CAS Name: 4-morpholinyl-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone IUPAC Name: morpholin-4-yl-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone Traditional Name: morpholino-[3-(3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]methanone Formula: C17H23N5O4 MolecularWeight: 361.39562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O4/c23-14(20-1-3-26-4-2-20)16-6-12-5-13(7-16)9-17(8-12,10-16)21-11-18-15(19-21)22(24)25/h11-13H,1-10H2