4-[4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2,5-bis(oxidanylidene)imidazolidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2,5-bis(oxidanylidene)imidazolidin-4-yl]benzenecarbonitrile Openeye Name: 4-[4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2,5-dioxo-imidazolidin-4-yl]benzonitrile CAS Name: 4-[4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2,5-dioxo-4-imidazolidinyl]benzonitrile IUPAC Name: 4-[4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2,5-dioxoimidazolidin-4-yl]benzonitrile Traditional Name: 4-[2,5-diketo-4-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidin-4-yl]benzonitrile Formula: C20H16N4O6 MolecularWeight: 408.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H16N4O6/c1-20(15-4-2-12(8-21)3-5-15)18(25)23(19(26)22-20)9-13-6-16(24(27)28)7-14-10-29-11-30-17(13)14/h2-7H,9-11H2,1H3,(H,22,26)