5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidine-2,4-dione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidine-2,4-dione Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidine-2,4-dione CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidine-2,4-dione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]imidazolidine-2,4-dione Traditional Name: 5-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-5-piperonyl-hydantoin Formula: C21H19N3O8 MolecularWeight: 441.39086

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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)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O8/c1-21(7-12-2-3-16-17(4-12)31-11-30-16)19(25)23(20(26)22-21)8-13-5-15(24(27)28)6-14-9-29-10-32-18(13)14/h2-6H,7-11H2,1H3,(H,22,26)