1-[4-(4-octoxyphenyl)phenoxy]propan-2-yl propanoate

Systemtic Name: 1-[4-(4-octoxyphenyl)phenoxy]propan-2-yl propanoate Openeye Name: [1-methyl-2-[4-(4-octoxyphenyl)phenoxy]ethyl] propanoate CAS Name: propanoic acid 1-[4-(4-octoxyphenyl)phenoxy]propan-2-yl ester IUPAC Name: 1-[4-(4-octoxyphenyl)phenoxy]propan-2-yl propanoate Traditional Name: propionic acid [1-methyl-2-[4-(4-octoxyphenyl)phenoxy]ethyl] ester Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CC

InChI

InChI=1S/C26H36O4/c1-4-6-7-8-9-10-19-28-24-15-11-22(12-16-24)23-13-17-25(18-14-23)29-20-21(3)30-26(27)5-2/h11-18,21H,4-10,19-20H2,1-3H3