N3,N3,N9,N9-tetrakis(4-ethylphenyl)perylene-3,9-diamine

Systemtic Name: N3,N3,N9,N9-tetrakis(4-ethylphenyl)perylene-3,9-diamine Openeye Name: N3,N3,N9,N9-tetrakis(4-ethylphenyl)perylene-3,9-diamine CAS Name: N3,N3,N9,N9-tetrakis(4-ethylphenyl)perylene-3,9-diamine IUPAC Name: 3-N,3-N,9-N,9-N-tetrakis(4-ethylphenyl)perylene-3,9-diamine Traditional Name: [9-(4-ethyl-N-(4-ethylphenyl)anilino)perylen-3-yl]-bis(4-ethylphenyl)amine Formula: C52H46N2 MolecularWeight: 698.93504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CC)C3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)N(C8=CC=C(C=C8)CC)C9=CC=C(C=C9)CC

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CC)C3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)N(C8=CC=C(C=C8)CC)C9=CC=C(C=C9)CC

InChI

InChI=1S/C52H46N2/c1-5-35-15-23-39(24-16-35)53(40-25-17-36(6-2)18-26-40)49-33-31-45-44-12-10-14-48-50(34-32-46(52(44)48)43-11-9-13-47(49)51(43)45)54(41-27-19-37(7-3)20-28-41)42-29-21-38(8-4)22-30-42/h9-34H,5-8H2,1-4H3