4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline

Systemtic Name: 4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline CAS Name: 4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline IUPAC Name: 4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline Traditional Name: 4,7-diphenyl-2,9-bis(2,4,6-triethylphenyl)-1,10-phenanthroline Formula: C48H48N2 MolecularWeight: 652.90812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)CC)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C(C=C(C=C6CC)CC)CC)C(=C2)C7=CC=CC=C7)CC

Isomeric SMILES

CCC1=CC(=C(C(=C1)CC)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C(C=C(C=C6CC)CC)CC)C(=C2)C7=CC=CC=C7)CC

InChI

InChI=1S/C48H48N2/c1-7-31-25-33(9-3)45(34(10-4)26-31)43-29-41(37-19-15-13-16-20-37)39-23-24-40-42(38-21-17-14-18-22-38)30-44(50-48(40)47(39)49-43)46-35(11-5)27-32(8-2)28-36(46)12-6/h13-30H,7-12H2,1-6H3