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

Systemtic Name: 2,4-bis[butyl-[3-(trifluoromethyl)phenyl]amino]cyclobutane-1,3-dione Openeye Name: 2,4-bis[N-butyl-3-(trifluoromethyl)anilino]cyclobutane-1,3-dione CAS Name: 2,4-bis[N-butyl-3-(trifluoromethyl)anilino]cyclobutane-1,3-dione IUPAC Name: 2,4-bis[N-butyl-3-(trifluoromethyl)anilino]cyclobutane-1,3-dione Traditional Name: 2,4-bis[N-butyl-3-(trifluoromethyl)anilino]cyclobutane-1,3-quinone Formula: C26H28F6N2O2 MolecularWeight: 514.503139

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28F6N2O2/c1-3-5-13-33(19-11-7-9-17(15-19)25(27,28)29)21-23(35)22(24(21)36)34(14-6-4-2)20-12-8-10-18(16-20)26(30,31)32/h7-12,15-16,21-22H,3-6,13-14H2,1-2H3