3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde

Systemtic Name: 3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde Openeye Name: 3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde CAS Name: 3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde IUPAC Name: 3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde Traditional Name: 3,5-bis[2-[4-(2-ethylhexoxy)phenyl]ethynyl]benzaldehyde Formula: C39H46O3 MolecularWeight: 562.78074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=CC=C(C=C1)C#CC2=CC(=CC(=C2)C=O)C#CC3=CC=C(C=C3)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC1=CC=C(C=C1)C#CC2=CC(=CC(=C2)C=O)C#CC3=CC=C(C=C3)OCC(CC)CCCC

InChI

InChI=1S/C39H46O3/c1-5-9-11-31(7-3)29-41-38-21-17-33(18-22-38)13-15-35-25-36(27-37(26-35)28-40)16-14-34-19-23-39(24-20-34)42-30-32(8-4)12-10-6-2/h17-28,31-32H,5-12,29-30H2,1-4H3