3-chloranyl-N,N-bis[4-[4-[(4-methylphenyl)-phenyl-amino]phenyl]phenyl]aniline

Systemtic Name: 3-chloranyl-N,N-bis[4-[4-[(4-methylphenyl)-phenyl-amino]phenyl]phenyl]aniline Openeye Name: 3-chloro-N,N-bis[4-[4-[N-(p-tolyl)anilino]phenyl]phenyl]aniline CAS Name: 3-chloro-N,N-bis[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]aniline IUPAC Name: 3-chloro-N,N-bis[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]aniline Traditional Name: (3-chlorophenyl)-bis[4-[4-[N-(p-tolyl)anilino]phenyl]phenyl]amine Formula: C56H44ClN3 MolecularWeight: 794.42166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=C(C=C5)C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C=C8)C)C9=CC(=CC=C9)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=C(C=C5)C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C=C8)C)C9=CC(=CC=C9)Cl

InChI

InChI=1S/C56H44ClN3/c1-41-16-28-50(29-17-41)58(48-11-5-3-6-12-48)52-32-20-43(21-33-52)45-24-36-54(37-25-45)60(56-15-9-10-47(57)40-56)55-38-26-46(27-39-55)44-22-34-53(35-23-44)59(49-13-7-4-8-14-49)51-30-18-42(2)19-31-51/h3-40H,1-2H3