2,4-bis[[3,5-bis(trifluoromethyl)phenyl]-propan-2-yl-amino]cyclobutane-1,3-dione

Systemtic Name: 2,4-bis[[3,5-bis(trifluoromethyl)phenyl]-propan-2-yl-amino]cyclobutane-1,3-dione Openeye Name: 2,4-bis[N-isopropyl-3,5-bis(trifluoromethyl)anilino]cyclobutane-1,3-dione CAS Name: 2,4-bis[N-propan-2-yl-3,5-bis(trifluoromethyl)anilino]cyclobutane-1,3-dione IUPAC Name: 2,4-bis[N-propan-2-yl-3,5-bis(trifluoromethyl)anilino]cyclobutane-1,3-dione Traditional Name: 2,4-bis[N-isopropyl-3,5-bis(trifluoromethyl)anilino]cyclobutane-1,3-quinone Formula: C26H22F12N2O2 MolecularWeight: 622.445918

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)C(F)(F)F)C(F)(F)F)C(C)C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C26H22F12N2O2/c1-11(2)39(17-7-13(23(27,28)29)5-14(8-17)24(30,31)32)19-21(41)20(22(19)42)40(12(3)4)18-9-15(25(33,34)35)6-16(10-18)26(36,37)38/h5-12,19-20H,1-4H3