2-[2-(4-butoxyphenyl)-1-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-butoxyphenyl)-1-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(4-butoxyphenyl)-1-(3-fluoro-4-methyl-phenyl)-4-oxo-azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(4-butoxyphenyl)-1-(3-fluoro-4-methylphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-butoxyphenyl)-1-(3-fluoro-4-methylphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(4-butoxyphenyl)-1-(3-fluoro-4-methyl-phenyl)-4-keto-azetidin-3-yl]isoindoline-1,3-quinone Formula: C28H25FN2O4 MolecularWeight: 472.507503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=O)N2C3=CC(=C(C=C3)C)F)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(C(=O)N2C3=CC(=C(C=C3)C)F)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H25FN2O4/c1-3-4-15-35-20-13-10-18(11-14-20)24-25(28(34)30(24)19-12-9-17(2)23(29)16-19)31-26(32)21-7-5-6-8-22(21)27(31)33/h5-14,16,24-25H,3-4,15H2,1-2H3