2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis[1-(2,5-dimethylphenyl)ethyl]-4,7-diphenyl-1,10-phenanthroline Formula: C44H40N2 MolecularWeight: 596.8018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C(C)C6=C(C=CC(=C6)C)C)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C(C)C6=C(C=CC(=C6)C)C)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C44H40N2/c1-27-17-19-29(3)37(23-27)31(5)41-25-39(33-13-9-7-10-14-33)35-21-22-36-40(34-15-11-8-12-16-34)26-42(46-44(36)43(35)45-41)32(6)38-24-28(2)18-20-30(38)4/h7-26,31-32H,1-6H3