8-[3-[8-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]phenyl]-1,3a-dihydropyrene

Systemtic Name: 8-[3-[8-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]phenyl]-1,3a-dihydropyrene Openeye Name: 8-[3-[8-(6-phenyl-2-naphthyl)-2-naphthyl]phenyl]-1,3a-dihydropyrene CAS Name: 8-[3-[8-(6-phenyl-2-naphthalenyl)-2-naphthalenyl]phenyl]-1,3a-dihydropyrene IUPAC Name: 8-[3-[8-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]phenyl]-1,3a-dihydropyrene Traditional Name: 8-[3-[8-(6-phenyl-2-naphthyl)-2-naphthyl]phenyl]-1,3a-dihydropyrene Formula: C48H32 MolecularWeight: 608.76768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2C=CC3=C4C2=C1C=CC4=C(C=C3)C5=CC=CC(=C5)C6=CC7=C(C=CC=C7C8=CC9=C(C=C8)C=C(C=C9)C1=CC=CC=C1)C=C6

Isomeric SMILES

C1C=CC2C=CC3=C4C2=C1C=CC4=C(C=C3)C5=CC=CC(=C5)C6=CC7=C(C=CC=C7C8=CC9=C(C=C8)C=C(C=C9)C1=CC=CC=C1)C=C6

InChI

InChI=1S/C48H32/c1-2-7-31(8-3-1)37-19-20-39-29-42(22-21-38(39)27-37)43-14-6-9-32-15-18-40(30-46(32)43)36-12-5-13-41(28-36)44-25-23-35-17-16-33-10-4-11-34-24-26-45(44)48(35)47(33)34/h1-10,12-30,33H,11H2