2,4-bis[(3-fluorophenyl)-propan-2-yl-amino]cyclobutane-1,3-dione

Systemtic Name: 2,4-bis[(3-fluorophenyl)-propan-2-yl-amino]cyclobutane-1,3-dione Openeye Name: 2,4-bis(3-fluoro-N-isopropyl-anilino)cyclobutane-1,3-dione CAS Name: 2,4-bis(3-fluoro-N-propan-2-ylanilino)cyclobutane-1,3-dione IUPAC Name: 2,4-bis(3-fluoro-N-propan-2-ylanilino)cyclobutane-1,3-dione Traditional Name: 2,4-bis(3-fluoro-N-isopropyl-anilino)cyclobutane-1,3-quinone Formula: C22H24F2N2O2 MolecularWeight: 386.434966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1C(=O)C(C1=O)N(C2=CC(=CC=C2)F)C(C)C)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)N(C1C(=O)C(C1=O)N(C2=CC(=CC=C2)F)C(C)C)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H24F2N2O2/c1-13(2)25(17-9-5-7-15(23)11-17)19-21(27)20(22(19)28)26(14(3)4)18-10-6-8-16(24)12-18/h5-14,19-20H,1-4H3