7-fluoranyl-4-(2-isoquinolin-5-yloxyethanoyl)-1,3,3-trimethyl-quinoxalin-2-one

Systemtic Name: 7-fluoranyl-4-(2-isoquinolin-5-yloxyethanoyl)-1,3,3-trimethyl-quinoxalin-2-one Openeye Name: 7-fluoro-4-[2-(5-isoquinolyloxy)acetyl]-1,3,3-trimethyl-quinoxalin-2-one CAS Name: 7-fluoro-4-[2-(5-isoquinolinyloxy)-1-oxoethyl]-1,3,3-trimethyl-2-quinoxalinone IUPAC Name: 7-fluoro-4-(2-isoquinolin-5-yloxyacetyl)-1,3,3-trimethylquinoxalin-2-one Traditional Name: 7-fluoro-4-[2-(5-isoquinolyloxy)acetyl]-1,3,3-trimethyl-quinoxalin-2-one Formula: C22H20FN3O3 MolecularWeight: 393.410903

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(N1C(=O)COC3=CC=CC4=C3C=CN=C4)C=CC(=C2)F)C)C

Isomeric SMILES

CC1(C(=O)N(C2=C(N1C(=O)COC3=CC=CC4=C3C=CN=C4)C=CC(=C2)F)C)C

InChI

InChI=1S/C22H20FN3O3/c1-22(2)21(28)25(3)18-11-15(23)7-8-17(18)26(22)20(27)13-29-19-6-4-5-14-12-24-10-9-16(14)19/h4-12H,13H2,1-3H3