1-(4-phenylmethoxyphenyl)ethyl octanoate

Systemtic Name: 1-(4-phenylmethoxyphenyl)ethyl octanoate Openeye Name: 1-(4-benzyloxyphenyl)ethyl octanoate CAS Name: octanoic acid 1-(4-phenylmethoxyphenyl)ethyl ester IUPAC Name: 1-(4-phenylmethoxyphenyl)ethyl octanoate Traditional Name: caprylic acid 1-(4-benzoxyphenyl)ethyl ester Formula: C23H30O3 MolecularWeight: 354.4825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30O3/c1-3-4-5-6-10-13-23(24)26-19(2)21-14-16-22(17-15-21)25-18-20-11-8-7-9-12-20/h7-9,11-12,14-17,19H,3-6,10,13,18H2,1-2H3