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

Systemtic Name: 2,9-bis(2,3-dimethylcyclohexyl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(2,3-dimethylcyclohexyl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(2,3-dimethylcyclohexyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(2,3-dimethylcyclohexyl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(2,3-dimethylcyclohexyl)-4,7-diphenyl-1,10-phenanthroline Formula: C40H44N2 MolecularWeight: 552.79076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6CCCC(C6C)C)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC1CCCC(C1C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6CCCC(C6C)C)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C40H44N2/c1-25-13-11-19-31(27(25)3)37-23-35(29-15-7-5-8-16-29)33-21-22-34-36(30-17-9-6-10-18-30)24-38(42-40(34)39(33)41-37)32-20-12-14-26(2)28(32)4/h5-10,15-18,21-28,31-32H,11-14,19-20H2,1-4H3