N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-(6-fluoro-4-keto-quinazolin-3-yl)acetamide Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C21H20FN3O4/c1-13(14-3-6-18-19(9-14)29-8-2-7-28-18)24-20(26)11-25-12-23-17-5-4-15(22)10-16(17)21(25)27/h3-6,9-10,12-13H,2,7-8,11H2,1H3,(H,24,26)