4-anthracen-1-yl-N,N-bis(4-anthracen-9-yl-2,5-dimethyl-phenyl)-2,5-dimethyl-aniline

Systemtic Name: 4-anthracen-1-yl-N,N-bis(4-anthracen-9-yl-2,5-dimethyl-phenyl)-2,5-dimethyl-aniline Openeye Name: 4-(1-anthryl)-N,N-bis[4-(9-anthryl)-2,5-dimethyl-phenyl]-2,5-dimethyl-aniline CAS Name: 4-(1-anthracenyl)-N,N-bis[4-(9-anthracenyl)-2,5-dimethylphenyl]-2,5-dimethylaniline IUPAC Name: 4-anthracen-1-yl-N,N-bis(4-anthracen-9-yl-2,5-dimethylphenyl)-2,5-dimethylaniline Traditional Name: [4-(1-anthryl)-2,5-dimethyl-phenyl]-bis[4-(9-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=C7C=CC=CC7=CC8=CC=CC=C86)C)C9=C(C=C(C(=C9)C)C1=C2C=CC=CC2=CC2=CC=CC=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=C7C=CC=CC7=CC8=CC=CC=C86)C)C9=C(C=C(C(=C9)C)C1=C2C=CC=CC2=CC2=CC=CC=C21)C

InChI

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