N,N-bis(3-methylbutyl)-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N,N-bis(3-methylbutyl)-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N,N-diisopentyl-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N,N-bis(3-methylbutyl)-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N,N-bis(3-methylbutyl)-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: 2-(1,3-diketo-5-nitro-isoindolin-2-yl)-N,N-diisoamyl-acetamide Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O5/c1-13(2)7-9-21(10-8-14(3)4)18(24)12-22-19(25)16-6-5-15(23(27)28)11-17(16)20(22)26/h5-6,11,13-14H,7-10,12H2,1-4H3