1-(4-phenylmethoxyphenyl)ethyl heptanoate

Systemtic Name: 1-(4-phenylmethoxyphenyl)ethyl heptanoate Openeye Name: 1-(4-benzyloxyphenyl)ethyl heptanoate CAS Name: heptanoic acid 1-(4-phenylmethoxyphenyl)ethyl ester IUPAC Name: 1-(4-phenylmethoxyphenyl)ethyl heptanoate Traditional Name: enanthic acid 1-(4-benzoxyphenyl)ethyl ester Formula: C22H28O3 MolecularWeight: 340.45592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(C)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)OC(C)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28O3/c1-3-4-5-9-12-22(23)25-18(2)20-13-15-21(16-14-20)24-17-19-10-7-6-8-11-19/h6-8,10-11,13-16,18H,3-5,9,12,17H2,1-2H3