N3,N9,N9-tris[4-(2-phenylpropan-2-yl)phenyl]perylene-3,9-diamine

Systemtic Name: N3,N9,N9-tris[4-(2-phenylpropan-2-yl)phenyl]perylene-3,9-diamine Openeye Name: N3,N9,N9-tris[4-(1-methyl-1-phenyl-ethyl)phenyl]perylene-3,9-diamine CAS Name: N3,N9,N9-tris[4-(2-phenylpropan-2-yl)phenyl]perylene-3,9-diamine IUPAC Name: 3-N,9-N,9-N-tris[4-(2-phenylpropan-2-yl)phenyl]perylene-3,9-diamine Traditional Name: [9-(4-cumylanilino)perylen-3-yl]-bis(4-cumylphenyl)amine Formula: C65H56N2 MolecularWeight: 865.15354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)N(C8=CC=C(C=C8)C(C)(C)C9=CC=CC=C9)C1=CC=C(C=C1)C(C)(C)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)N(C8=CC=C(C=C8)C(C)(C)C9=CC=CC=C9)C1=CC=C(C=C1)C(C)(C)C1=CC=CC=C1

InChI

InChI=1S/C65H56N2/c1-63(2,44-18-10-7-11-19-44)47-28-34-50(35-29-47)66-59-42-40-55-54-25-17-27-58-60(43-41-56(62(54)58)53-24-16-26-57(59)61(53)55)67(51-36-30-48(31-37-51)64(3,4)45-20-12-8-13-21-45)52-38-32-49(33-39-52)65(5,6)46-22-14-9-15-23-46/h7-43,66H,1-6H3