4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloranyl-1,10-phenanthroline

Systemtic Name: 4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloranyl-1,10-phenanthroline Openeye Name: 4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,10-phenanthroline CAS Name: 4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,10-phenanthroline IUPAC Name: 4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,10-phenanthroline Traditional Name: 4,7-bis[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,10-phenanthroline Formula: C28H11ClF12N2 MolecularWeight: 638.834178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C2C(=C1C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C=C(C4=C(C=CN=C42)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F)Cl

Isomeric SMILES

C1=CN=C2C(=C1C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C=C(C4=C(C=CN=C42)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F)Cl

InChI

InChI=1S/C28H11ClF12N2/c29-21-11-20-18(12-5-14(25(30,31)32)9-15(6-12)26(33,34)35)1-3-42-23(20)24-22(21)19(2-4-43-24)13-7-16(27(36,37)38)10-17(8-13)28(39,40)41/h1-11H