2-[2-(1-adamantyl)ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(1-adamantyl)ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(1-adamantyl)ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(1-adamantyl)ethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(1-adamantyl)ethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(1-adamantyl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCN4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCN4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O4/c23-18-16-2-1-15(22(25)26)8-17(16)19(24)21(18)4-3-20-9-12-5-13(10-20)7-14(6-12)11-20/h1-2,8,12-14H,3-7,9-11H2