5-[4-(4-heptoxyphenyl)phenyl]-3-heptyl-oxolan-2-one

Systemtic Name: 5-[4-(4-heptoxyphenyl)phenyl]-3-heptyl-oxolan-2-one Openeye Name: 5-[4-(4-heptoxyphenyl)phenyl]-3-heptyl-tetrahydrofuran-2-one CAS Name: 5-[4-(4-heptoxyphenyl)phenyl]-3-heptyl-2-oxolanone IUPAC Name: 5-[4-(4-heptoxyphenyl)phenyl]-3-heptyloxolan-2-one Traditional Name: 5-[4-(4-heptoxyphenyl)phenyl]-3-heptyl-tetrahydrofuran-2-one Formula: C30H42O3 MolecularWeight: 450.65268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CC(OC1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCC

Isomeric SMILES

CCCCCCCC1CC(OC1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCC

InChI

InChI=1S/C30H42O3/c1-3-5-7-9-11-13-27-23-29(33-30(27)31)26-16-14-24(15-17-26)25-18-20-28(21-19-25)32-22-12-10-8-6-4-2/h14-21,27,29H,3-13,22-23H2,1-2H3