1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzimidazol-2-one

Systemtic Name: 1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzimidazol-2-one Openeye Name: 1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzimidazol-2-one CAS Name: 1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-2-benzimidazolone IUPAC Name: 1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzimidazol-2-one Traditional Name: 1-methyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzimidazol-2-one Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C17H15N3O5/c1-18-14-4-2-3-5-15(14)19(17(18)21)8-11-6-13(20(22)23)7-12-9-24-10-25-16(11)12/h2-7H,8-10H2,1H3