N-phenylaniline; 5,6,11,12-tetraphenyltetracene

Systemtic Name: N-phenylaniline; 5,6,11,12-tetraphenyltetracene Openeye Name: N-phenylaniline; 5,6,11,12-tetraphenyltetracene CAS Name: N-phenylaniline; 5,6,11,12-tetraphenyltetracene IUPAC Name: N-phenylaniline; 5,6,11,12-tetraphenyltetracene Traditional Name: diphenylamine; 5,6,11,12-tetraphenyltetracene Formula: C54H39N MolecularWeight: 701.89416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C42H28.C12H11N/c1-5-17-29(18-6-1)37-33-25-13-14-26-34(33)39(31-21-9-3-10-22-31)42-40(32-23-11-4-12-24-32)36-28-16-15-27-35(36)38(41(37)42)30-19-7-2-8-20-30;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-28H;1-10,13H