3-oxidanylbutyl 3-phenylpropanoate

Systemtic Name: 3-oxidanylbutyl 3-phenylpropanoate Openeye Name: 3-hydroxybutyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid 3-hydroxybutyl ester IUPAC Name: 3-hydroxybutyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid 3-hydroxybutyl ester Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)CCC1=CC=CC=C1)O

Isomeric SMILES

CC(CCOC(=O)CCC1=CC=CC=C1)O

InChI

InChI=1S/C13H18O3/c1-11(14)9-10-16-13(15)8-7-12-5-3-2-4-6-12/h2-6,11,14H,7-10H2,1H3