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

Systemtic Name: 2,9-bis[2-(1-methyl-9,10-dihydroanthracen-9-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis[1-methyl-1-(1-methyl-9,10-dihydroanthracen-9-yl)ethyl]-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis[2-(1-methyl-9,10-dihydroanthracen-9-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis[2-(1-methyl-9,10-dihydroanthracen-9-yl)propan-2-yl]-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis[1-methyl-1-(1-methyl-9,10-dihydroanthracen-9-yl)ethyl]-4,7-diphenyl-1,10-phenanthroline Formula: C60H52N2 MolecularWeight: 801.06828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(C3=CC=CC=C3C2)C(C)(C)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C(C)(C)C8C9=CC=CC=C9CC1=C8C(=CC=C1)C)C(=C4)C1=CC=CC=C1

Isomeric SMILES

CC1=CC=CC2=C1C(C3=CC=CC=C3C2)C(C)(C)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C(C)(C)C8C9=CC=CC=C9CC1=C8C(=CC=C1)C)C(=C4)C1=CC=CC=C1

InChI

InChI=1S/C60H52N2/c1-37-19-17-27-43-33-41-25-13-15-29-45(41)55(53(37)43)59(3,4)51-35-49(39-21-9-7-10-22-39)47-31-32-48-50(40-23-11-8-12-24-40)36-52(62-58(48)57(47)61-51)60(5,6)56-46-30-16-14-26-42(46)34-44-28-18-20-38(2)54(44)56/h7-32,35-36,55-56H,33-34H2,1-6H3