3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-fluoranylphenoxy)chromen-4-one

Systemtic Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-fluoranylphenoxy)chromen-4-one Openeye Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]-3-pyridyl]-7-(4-fluorophenoxy)chromen-4-one CAS Name: 3-[6-[3-(dimethylamino)-1-pyrrolidinyl]-3-pyridinyl]-7-(4-fluorophenoxy)-1-benzopyran-4-one IUPAC Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-fluorophenoxy)chromen-4-one Traditional Name: 3-[6-[3-(dimethylamino)pyrrolidino]-3-pyridyl]-7-(4-fluorophenoxy)chromone Formula: C26H24FN3O3 MolecularWeight: 445.485463

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C2=NC=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)OC5=CC=C(C=C5)F

Isomeric SMILES

CN(C)C1CCN(C1)C2=NC=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)OC5=CC=C(C=C5)F

InChI

InChI=1S/C26H24FN3O3/c1-29(2)19-11-12-30(15-19)25-10-3-17(14-28-25)23-16-32-24-13-21(8-9-22(24)26(23)31)33-20-6-4-18(27)5-7-20/h3-10,13-14,16,19H,11-12,15H2,1-2H3