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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN3C=NC4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN3C=NC4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

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