N-(1-adamantyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-(1-adamantyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(1-adamantyl)-5-morpholino-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(1-adamantyl)-5-(4-morpholinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(1-adamantyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: 1-adamantyl-(6-morpholino-7-nitro-benzofurazan-4-yl)amine Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C3=NON=C3C(=C2)NC45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C3=NON=C3C(=C2)NC45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O4/c26-25(27)19-16(24-1-3-28-4-2-24)8-15(17-18(19)23-29-22-17)21-20-9-12-5-13(10-20)7-14(6-12)11-20/h8,12-14,21H,1-7,9-11H2