2,5-di(phenanthren-9-yl)-3,4-diphenyl-thiophene

Systemtic Name: 2,5-di(phenanthren-9-yl)-3,4-diphenyl-thiophene Openeye Name: 2,5-bis(9-phenanthryl)-3,4-diphenyl-thiophene CAS Name: 2,5-bis(9-phenanthrenyl)-3,4-diphenylthiophene IUPAC Name: 2,5-di(phenanthren-9-yl)-3,4-diphenylthiophene Traditional Name: 2,5-bis(9-phenanthryl)-3,4-diphenyl-thiophene Formula: C44H28S MolecularWeight: 588.75812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=C2C3=CC=CC=C3)C4=CC5=CC=CC=C5C6=CC=CC=C64)C7=CC8=CC=CC=C8C9=CC=CC=C97

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=C2C3=CC=CC=C3)C4=CC5=CC=CC=C5C6=CC=CC=C64)C7=CC8=CC=CC=C8C9=CC=CC=C97

InChI

InChI=1S/C44H28S/c1-3-15-29(16-4-1)41-42(30-17-5-2-6-18-30)44(40-28-32-20-8-10-22-34(32)36-24-12-14-26-38(36)40)45-43(41)39-27-31-19-7-9-21-33(31)35-23-11-13-25-37(35)39/h1-28H