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

Systemtic Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]cinnolin-4-one Openeye Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]cinnolin-4-one CAS Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-cinnolinone IUPAC Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]cinnolin-4-one Traditional Name: 1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]cinnolin-4-one Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN3C4=CC=CC=C4C(=O)C=N3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN3C4=CC=CC=C4C(=O)C=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5/c21-16-7-18-19(15-4-2-1-3-14(15)16)8-11-5-13(20(22)23)6-12-9-24-10-25-17(11)12/h1-7H,8-10H2