(E)-3-[2-(5-acetyloxypentoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(5-acetyloxypentoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(5-acetoxypentoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(5-acetyloxypentoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(5-acetyloxypentoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(5-acetoxypentoxy)phenyl]acrylic acid Formula: C16H20O5 MolecularWeight: 292.327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCOC1=CC=CC=C1C=CC(=O)O

Isomeric SMILES

CC(=O)OCCCCCOC1=CC=CC=C1/C=C/C(=O)O

InChI

InChI=1S/C16H20O5/c1-13(17)20-11-5-2-6-12-21-15-8-4-3-7-14(15)9-10-16(18)19/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,18,19)/b10-9+