2,9-bis(4-cyclohexyl-2,5-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis(4-cyclohexyl-2,5-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(4-cyclohexyl-2,5-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(4-cyclohexyl-2,5-dimethylphenyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(4-cyclohexyl-2,5-dimethylphenyl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(4-cyclohexyl-2,5-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline Formula: C52H52N2 MolecularWeight: 704.98268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=CC(=C(C=C6C)C7CCCCC7)C)C(=C2)C8=CC=CC=C8)C)C9CCCCC9

Isomeric SMILES

CC1=CC(=C(C=C1C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=CC(=C(C=C6C)C7CCCCC7)C)C(=C2)C8=CC=CC=C8)C)C9CCCCC9

InChI

InChI=1S/C52H52N2/c1-33-29-45(35(3)27-43(33)37-17-9-5-10-18-37)49-31-47(39-21-13-7-14-22-39)41-25-26-42-48(40-23-15-8-16-24-40)32-50(54-52(42)51(41)53-49)46-30-34(2)44(28-36(46)4)38-19-11-6-12-20-38/h7-8,13-16,21-32,37-38H,5-6,9-12,17-20H2,1-4H3