3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoranyl-quinazolin-4-one

Systemtic Name: 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoranyl-quinazolin-4-one Openeye Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoro-quinazolin-4-one CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoro-4-quinazolinone IUPAC Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoroquinazolin-4-one Traditional Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-7-fluoro-quinazolin-4-one Formula: C18H14ClFN2O3 MolecularWeight: 360.766763

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CN3C=NC4=C(C3=O)C=CC(=C4)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CN3C=NC4=C(C3=O)C=CC(=C4)F)Cl)OC1

InChI

InChI=1S/C18H14ClFN2O3/c19-14-6-11(7-16-17(14)25-5-1-4-24-16)9-22-10-21-15-8-12(20)2-3-13(15)18(22)23/h2-3,6-8,10H,1,4-5,9H2