5-azanyl-6,8-bis(fluoranyl)-2-[3-fluoranyl-4-(2-pyrrolidin-1-ylethylamino)phenyl]chromen-4-one

Systemtic Name: 5-azanyl-6,8-bis(fluoranyl)-2-[3-fluoranyl-4-(2-pyrrolidin-1-ylethylamino)phenyl]chromen-4-one Openeye Name: 5-amino-6,8-difluoro-2-[3-fluoro-4-(2-pyrrolidin-1-ylethylamino)phenyl]chromen-4-one CAS Name: 5-amino-6,8-difluoro-2-[3-fluoro-4-[2-(1-pyrrolidinyl)ethylamino]phenyl]-1-benzopyran-4-one IUPAC Name: 5-amino-6,8-difluoro-2-[3-fluoro-4-(2-pyrrolidin-1-ylethylamino)phenyl]chromen-4-one Traditional Name: 5-amino-6,8-difluoro-2-[3-fluoro-4-(2-pyrrolidinoethylamino)phenyl]chromone Formula: C21H20F3N3O2 MolecularWeight: 403.39761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=CC(=C4O3)F)F)N)F

Isomeric SMILES

C1CCN(C1)CCNC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=CC(=C4O3)F)F)N)F

InChI

InChI=1S/C21H20F3N3O2/c22-13-9-12(3-4-16(13)26-5-8-27-6-1-2-7-27)18-11-17(28)19-20(25)14(23)10-15(24)21(19)29-18/h3-4,9-11,26H,1-2,5-8,25H2