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

Systemtic Name: 2,9-bis[(4-methylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(p-tolylmethyl)-1,10-phenanthroline CAS Name: 2,9-bis[(4-methylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis[(4-methylphenyl)methyl]-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(4-methylbenzyl)-4,7-diphenyl-1,10-phenanthroline Formula: C40H32N2 MolecularWeight: 540.69548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)CC6=CC=C(C=C6)C)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)CC6=CC=C(C=C6)C)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C40H32N2/c1-27-13-17-29(18-14-27)23-33-25-37(31-9-5-3-6-10-31)35-21-22-36-38(32-11-7-4-8-12-32)26-34(42-40(36)39(35)41-33)24-30-19-15-28(2)16-20-30/h3-22,25-26H,23-24H2,1-2H3