N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide

Systemtic Name: N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: 3-(4-ketoquinazolin-3-yl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propionamide Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])NC(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])NC(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C19H16N4O6/c24-18(5-6-22-11-20-13-4-2-1-3-12(13)19(22)25)21-14-9-16-17(29-8-7-28-16)10-15(14)23(26)27/h1-4,9-11H,5-8H2,(H,21,24)