4,7-diphenyl-2,9-bis(2,4,8-trimethylnaphthalen-1-yl)-1,10-phenanthroline

Systemtic Name: 4,7-diphenyl-2,9-bis(2,4,8-trimethylnaphthalen-1-yl)-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(2,4,8-trimethyl-1-naphthyl)-1,10-phenanthroline CAS Name: 4,7-diphenyl-2,9-bis(2,4,8-trimethyl-1-naphthalenyl)-1,10-phenanthroline IUPAC Name: 4,7-diphenyl-2,9-bis(2,4,8-trimethylnaphthalen-1-yl)-1,10-phenanthroline Traditional Name: 4,7-diphenyl-2,9-bis(2,4,8-trimethyl-1-naphthyl)-1,10-phenanthroline Formula: C50H40N2 MolecularWeight: 668.866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=C(C=C2C)C)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C7=C(C=C(C8=C7C(=CC=C8)C)C)C)C(=C3)C9=CC=CC=C9

Isomeric SMILES

CC1=CC=CC2=C1C(=C(C=C2C)C)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C7=C(C=C(C8=C7C(=CC=C8)C)C)C)C(=C3)C9=CC=CC=C9

InChI

InChI=1S/C50H40N2/c1-29-15-13-21-37-31(3)25-33(5)47(45(29)37)43-27-41(35-17-9-7-10-18-35)39-23-24-40-42(36-19-11-8-12-20-36)28-44(52-50(40)49(39)51-43)48-34(6)26-32(4)38-22-14-16-30(2)46(38)48/h7-28H,1-6H3