1-[4-(4-pentylphenyl)phenoxy]propan-2-yl ethanoate

Systemtic Name: 1-[4-(4-pentylphenyl)phenoxy]propan-2-yl ethanoate Openeye Name: [1-methyl-2-[4-(4-pentylphenyl)phenoxy]ethyl] acetate CAS Name: acetic acid 1-[4-(4-pentylphenyl)phenoxy]propan-2-yl ester IUPAC Name: 1-[4-(4-pentylphenyl)phenoxy]propan-2-yl acetate Traditional Name: acetic acid [2-[4-(4-amylphenyl)phenoxy]-1-methyl-ethyl] ester Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)C

InChI

InChI=1S/C22H28O3/c1-4-5-6-7-19-8-10-20(11-9-19)21-12-14-22(15-13-21)24-16-17(2)25-18(3)23/h8-15,17H,4-7,16H2,1-3H3