N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: 2-(6-bromo-4-oxo-quinazolin-3-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide CAS Name: 2-(6-bromo-4-oxo-3-quinazolinyl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(6-bromo-4-oxoquinazolin-3-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-(6-bromo-4-keto-quinazolin-3-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide Formula: C17H10BrF2N3O4 MolecularWeight: 438.179806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br)OC(O2)(F)F

InChI

InChI=1S/C17H10BrF2N3O4/c18-9-1-3-12-11(5-9)16(25)23(8-21-12)7-15(24)22-10-2-4-13-14(6-10)27-17(19,20)26-13/h1-6,8H,7H2,(H,22,24)