2,9-bis[2-(2-methylnaphthalen-1-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis[2-(2-methylnaphthalen-1-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis[1-methyl-1-(2-methyl-1-naphthyl)ethyl]-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis[2-(2-methyl-1-naphthalenyl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis[2-(2-methylnaphthalen-1-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis[1-methyl-1-(2-methyl-1-naphthyl)ethyl]-4,7-diphenyl-1,10-phenanthroline Formula: C52H44N2 MolecularWeight: 696.91916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)C(C)(C)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C(C)(C)C7=C(C=CC8=CC=CC=C87)C)C(=C3)C9=CC=CC=C9

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)C(C)(C)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C(C)(C)C7=C(C=CC8=CC=CC=C87)C)C(=C3)C9=CC=CC=C9

InChI

InChI=1S/C52H44N2/c1-33-25-27-37-21-13-15-23-39(37)47(33)51(3,4)45-31-43(35-17-9-7-10-18-35)41-29-30-42-44(36-19-11-8-12-20-36)32-46(54-50(42)49(41)53-45)52(5,6)48-34(2)26-28-38-22-14-16-24-40(38)48/h7-32H,1-6H3