ethyl (2S)-2-acetyloxy-4-[4-(4-hexylphenyl)phenoxy]butanoate

Systemtic Name: ethyl (2S)-2-acetyloxy-4-[4-(4-hexylphenyl)phenoxy]butanoate Openeye Name: ethyl (2S)-2-acetoxy-4-[4-(4-hexylphenyl)phenoxy]butanoate CAS Name: (2S)-2-acetyloxy-4-[4-(4-hexylphenyl)phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-acetyloxy-4-[4-(4-hexylphenyl)phenoxy]butanoate Traditional Name: (2S)-2-acetoxy-4-[4-(4-hexylphenyl)phenoxy]butyric acid ethyl ester Formula: C26H34O5 MolecularWeight: 426.54516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCCC(C(=O)OCC)OC(=O)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC[C@@H](C(=O)OCC)OC(=O)C

InChI

InChI=1S/C26H34O5/c1-4-6-7-8-9-21-10-12-22(13-11-21)23-14-16-24(17-15-23)30-19-18-25(31-20(3)27)26(28)29-5-2/h10-17,25H,4-9,18-19H2,1-3H3/t25-/m0/s1