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

Systemtic Name: N,N-dicyclohexyl-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N,N-dicyclohexyl-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N,N-dicyclohexyl-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N,N-dicyclohexyl-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N,N-dicyclohexyl-2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5/c26-20(24(15-7-3-1-4-8-15)16-9-5-2-6-10-16)14-23-21(27)18-12-11-17(25(29)30)13-19(18)22(23)28/h11-13,15-16H,1-10,14H2