2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]-1,3-oxazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]-1,3-oxazol-4-yl]ethanoic acid Openeye Name: 2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]oxazol-4-yl]acetic acid CAS Name: 2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]-4-oxazolyl]acetic acid IUPAC Name: 2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]-1,3-oxazol-4-yl]acetic acid Traditional Name: 2-[5-ethoxy-2-[4-[(E)-octadec-9-enoxy]phenyl]oxazol-4-yl]acetic acid Formula: C31H47NO5 MolecularWeight: 513.70858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(O2)OCC)CC(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(O2)OCC)CC(=O)O

InChI

InChI=1S/C31H47NO5/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-36-27-22-20-26(21-23-27)30-32-28(25-29(33)34)31(37-30)35-4-2/h11-12,20-23H,3-10,13-19,24-25H2,1-2H3,(H,33,34)/b12-11+