4-anthracen-1-yl-N,N-bis(4-anthracen-1-yl-2,5-dimethyl-phenyl)-2,5-dimethyl-aniline

Systemtic Name: 4-anthracen-1-yl-N,N-bis(4-anthracen-1-yl-2,5-dimethyl-phenyl)-2,5-dimethyl-aniline Openeye Name: 4-(1-anthryl)-N,N-bis[4-(1-anthryl)-2,5-dimethyl-phenyl]-2,5-dimethyl-aniline CAS Name: 4-(1-anthracenyl)-N,N-bis[4-(1-anthracenyl)-2,5-dimethylphenyl]-2,5-dimethylaniline IUPAC Name: 4-anthracen-1-yl-N,N-bis(4-anthracen-1-yl-2,5-dimethylphenyl)-2,5-dimethylaniline Traditional Name: tris[4-(1-anthryl)-2,5-dimethyl-phenyl]amine Formula: C66H51N MolecularWeight: 858.11784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC=CC3=CC4=CC=CC=C4C=C32)C)N(C5=C(C=C(C(=C5)C)C6=CC=CC7=CC8=CC=CC=C8C=C76)C)C9=C(C=C(C(=C9)C)C1=CC=CC2=CC3=CC=CC=C3C=C21)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC=CC3=CC4=CC=CC=C4C=C32)C)N(C5=C(C=C(C(=C5)C)C6=CC=CC7=CC8=CC=CC=C8C=C76)C)C9=C(C=C(C(=C9)C)C1=CC=CC2=CC3=CC=CC=C3C=C21)C

InChI

InChI=1S/C66H51N/c1-40-31-64(43(4)28-58(40)55-25-13-22-52-34-46-16-7-10-19-49(46)37-61(52)55)67(65-32-41(2)59(29-44(65)5)56-26-14-23-53-35-47-17-8-11-20-50(47)38-62(53)56)66-33-42(3)60(30-45(66)6)57-27-15-24-54-36-48-18-9-12-21-51(48)39-63(54)57/h7-39H,1-6H3