1,5-bis(4-octoxyphenyl)-3-phenyl-pentane-1,5-dione

Systemtic Name: 1,5-bis(4-octoxyphenyl)-3-phenyl-pentane-1,5-dione Openeye Name: 1,5-bis(4-octoxyphenyl)-3-phenyl-pentane-1,5-dione CAS Name: 1,5-bis(4-octoxyphenyl)-3-phenylpentane-1,5-dione IUPAC Name: 1,5-bis(4-octoxyphenyl)-3-phenylpentane-1,5-dione Traditional Name: 1,5-bis(4-octoxyphenyl)-3-phenyl-pentane-1,5-dione Formula: C39H52O4 MolecularWeight: 584.82778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)OCCCCCCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)OCCCCCCCC)C3=CC=CC=C3

InChI

InChI=1S/C39H52O4/c1-3-5-7-9-11-16-28-42-36-24-20-33(21-25-36)38(40)30-35(32-18-14-13-15-19-32)31-39(41)34-22-26-37(27-23-34)43-29-17-12-10-8-6-4-2/h13-15,18-27,35H,3-12,16-17,28-31H2,1-2H3