1-(4-phenylmethoxyphenyl)ethyl hexanoate

Systemtic Name: 1-(4-phenylmethoxyphenyl)ethyl hexanoate Openeye Name: 1-(4-benzyloxyphenyl)ethyl hexanoate CAS Name: hexanoic acid 1-(4-phenylmethoxyphenyl)ethyl ester IUPAC Name: 1-(4-phenylmethoxyphenyl)ethyl hexanoate Traditional Name: hexanoic acid 1-(4-benzoxyphenyl)ethyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26O3/c1-3-4-6-11-21(22)24-17(2)19-12-14-20(15-13-19)23-16-18-9-7-5-8-10-18/h5,7-10,12-15,17H,3-4,6,11,16H2,1-2H3