N-[1-(1-adamantyl)propyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O5/c1-2-18(23-9-13-6-14(10-23)8-15(7-13)11-23)24-19(27)12-25-21(28)16-4-3-5-17(26(30)31)20(16)22(25)29/h3-5,13-15,18H,2,6-12H2,1H3,(H,24,27)