3-[2-[(4-tert-butylphenyl)methylamino]-5-fluoranyl-phenyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[2-[(4-tert-butylphenyl)methylamino]-5-fluoranyl-phenyl]-1H-quinoxalin-2-one Openeye Name: 3-[2-[(4-tert-butylphenyl)methylamino]-5-fluoro-phenyl]-1H-quinoxalin-2-one CAS Name: 3-[2-[(4-tert-butylphenyl)methylamino]-5-fluorophenyl]-1H-quinoxalin-2-one IUPAC Name: 3-[2-[(4-tert-butylphenyl)methylamino]-5-fluorophenyl]-1H-quinoxalin-2-one Traditional Name: 3-[2-[(4-tert-butylbenzyl)amino]-5-fluoro-phenyl]-1H-quinoxalin-2-one Formula: C25H24FN3O MolecularWeight: 401.475963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)C3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C25H24FN3O/c1-25(2,3)17-10-8-16(9-11-17)15-27-20-13-12-18(26)14-19(20)23-24(30)29-22-7-5-4-6-21(22)28-23/h4-14,27H,15H2,1-3H3,(H,29,30)