3-[2-nonyl-3-[2-nonyl-3-(2-oxidanyl-3-oxidanylidene-propyl)phenoxy]phenyl]-2-oxidanyl-propanal

Systemtic Name: 3-[2-nonyl-3-[2-nonyl-3-(2-oxidanyl-3-oxidanylidene-propyl)phenoxy]phenyl]-2-oxidanyl-propanal Openeye Name: 2-hydroxy-3-[3-[3-(2-hydroxy-3-oxo-propyl)-2-nonyl-phenoxy]-2-nonyl-phenyl]propanal CAS Name: 2-hydroxy-3-[3-[3-(2-hydroxy-3-oxopropyl)-2-nonylphenoxy]-2-nonylphenyl]propanal IUPAC Name: 2-hydroxy-3-[3-[3-(2-hydroxy-3-oxopropyl)-2-nonylphenoxy]-2-nonylphenyl]propanal Traditional Name: 2-hydroxy-3-[3-[3-(2-hydroxy-3-keto-propyl)-2-nonyl-phenoxy]-2-nonyl-phenyl]propionaldehyde Formula: C36H54O5 MolecularWeight: 566.81096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C=CC=C1OC2=CC=CC(=C2CCCCCCCCC)CC(C=O)O)CC(C=O)O

Isomeric SMILES

CCCCCCCCCC1=C(C=CC=C1OC2=CC=CC(=C2CCCCCCCCC)CC(C=O)O)CC(C=O)O

InChI

InChI=1S/C36H54O5/c1-3-5-7-9-11-13-15-21-33-29(25-31(39)27-37)19-17-23-35(33)41-36-24-18-20-30(26-32(40)28-38)34(36)22-16-14-12-10-8-6-4-2/h17-20,23-24,27-28,31-32,39-40H,3-16,21-22,25-26H2,1-2H3