9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene

Systemtic Name: 9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene Openeye Name: 9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene CAS Name: 9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene IUPAC Name: 9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene Traditional Name: 9,10-bis(4-bromophenyl)-3,6-di(nonyl)phenanthrene Formula: C44H52Br2 MolecularWeight: 740.69168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=C(C=C1)C(=C(C3=C2C=C(C=C3)CCCCCCCCC)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br

Isomeric SMILES

CCCCCCCCCC1=CC2=C(C=C1)C(=C(C3=C2C=C(C=C3)CCCCCCCCC)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br

InChI

InChI=1S/C44H52Br2/c1-3-5-7-9-11-13-15-17-33-19-29-39-41(31-33)42-32-34(18-16-14-12-10-8-6-4-2)20-30-40(42)44(36-23-27-38(46)28-24-36)43(39)35-21-25-37(45)26-22-35/h19-32H,3-18H2,1-2H3