N6,N12-bis[4-(diphenylamino)phenyl]-N6,N12-diphenyl-chrysene-6,12-diamine

Systemtic Name: N6,N12-bis[4-(diphenylamino)phenyl]-N6,N12-diphenyl-chrysene-6,12-diamine Openeye Name: N6,N12-diphenyl-N6,N12-bis[4-(N-phenylanilino)phenyl]chrysene-6,12-diamine CAS Name: N6,N12-diphenyl-N6,N12-bis[4-(N-phenylanilino)phenyl]chrysene-6,12-diamine IUPAC Name: 6-N,12-N-diphenyl-6-N,12-N-bis[4-(N-phenylanilino)phenyl]chrysene-6,12-diamine Traditional Name: diphenyl-[4-(N-[12-(N-[4-(N-phenylanilino)phenyl]anilino)chrysen-6-yl]anilino)phenyl]amine Formula: C66H48N4 MolecularWeight: 897.11412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C(C7=CC=CC=C76)N(C8=CC=CC=C8)C9=CC=C(C=C9)N(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C15

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C(C7=CC=CC=C76)N(C8=CC=CC=C8)C9=CC=C(C=C9)N(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C15

InChI

InChI=1S/C66H48N4/c1-7-23-49(24-8-1)67(50-25-9-2-10-26-50)55-39-43-57(44-40-55)69(53-31-15-5-16-32-53)65-47-63-60-36-20-22-38-62(60)66(48-64(63)59-35-19-21-37-61(59)65)70(54-33-17-6-18-34-54)58-45-41-56(42-46-58)68(51-27-11-3-12-28-51)52-29-13-4-14-30-52/h1-48H