2,9-bis[(2,6-dimethylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis[(2,6-dimethylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis[(2,6-dimethylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis[(2,6-dimethylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis[(2,6-dimethylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(2,6-dimethylbenzyl)-4,7-diphenyl-1,10-phenanthroline Formula: C42H36N2 MolecularWeight: 568.74864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CC2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)CC6=C(C=CC=C6C)C)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC1=C(C(=CC=C1)C)CC2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)CC6=C(C=CC=C6C)C)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C42H36N2/c1-27-13-11-14-28(2)37(27)23-33-25-39(31-17-7-5-8-18-31)35-21-22-36-40(32-19-9-6-10-20-32)26-34(44-42(36)41(35)43-33)24-38-29(3)15-12-16-30(38)4/h5-22,25-26H,23-24H2,1-4H3