2-[3-[[4-(5-azanyl-8-fluoranyl-4-oxidanylidene-chromen-2-yl)phenyl]amino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[[4-(5-azanyl-8-fluoranyl-4-oxidanylidene-chromen-2-yl)phenyl]amino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(5-amino-8-fluoro-4-oxo-chromen-2-yl)anilino]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(5-amino-8-fluoro-4-oxo-1-benzopyran-2-yl)anilino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(5-amino-8-fluoro-4-oxochromen-2-yl)anilino]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(5-amino-8-fluoro-4-keto-chromen-2-yl)anilino]propyl]isoindoline-1,3-quinone Formula: C26H20FN3O4 MolecularWeight: 457.453103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCNC3=CC=C(C=C3)C4=CC(=O)C5=C(C=CC(=C5O4)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCNC3=CC=C(C=C3)C4=CC(=O)C5=C(C=CC(=C5O4)F)N

InChI

InChI=1S/C26H20FN3O4/c27-19-10-11-20(28)23-21(31)14-22(34-24(19)23)15-6-8-16(9-7-15)29-12-3-13-30-25(32)17-4-1-2-5-18(17)26(30)33/h1-2,4-11,14,29H,3,12-13,28H2