4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline

Systemtic Name: 4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline CAS Name: 4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline IUPAC Name: 4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline Traditional Name: 4,7-diphenyl-2,9-bis(2,3,6-trimethylcyclohexyl)-1,10-phenanthroline Formula: C42H48N2 MolecularWeight: 580.84392

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6C(CCC(C6C)C)C)C(=C2)C7=CC=CC=C7)C

Isomeric SMILES

CC1CCC(C(C1C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6C(CCC(C6C)C)C)C(=C2)C7=CC=CC=C7)C

InChI

InChI=1S/C42H48N2/c1-25-17-19-27(3)39(29(25)5)37-23-35(31-13-9-7-10-14-31)33-21-22-34-36(32-15-11-8-12-16-32)24-38(44-42(34)41(33)43-37)40-28(4)20-18-26(2)30(40)6/h7-16,21-30,39-40H,17-20H2,1-6H3