N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-(4-ketoquinazolin-3-yl)butyramide Formula: C21H19N3O5 MolecularWeight: 393.39266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CCCN3C=NC4=CC=CC=C4C3=O)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CCCN3C=NC4=CC=CC=C4C3=O)OCO2

InChI

InChI=1S/C21H19N3O5/c1-13(25)15-9-18-19(29-12-28-18)10-17(15)23-20(26)7-4-8-24-11-22-16-6-3-2-5-14(16)21(24)27/h2-3,5-6,9-11H,4,7-8,12H2,1H3,(H,23,26)