(2-octoxyphenyl) 4-(1-hexoxyethyl)benzoate

Systemtic Name: (2-octoxyphenyl) 4-(1-hexoxyethyl)benzoate Openeye Name: (2-octoxyphenyl) 4-(1-hexoxyethyl)benzoate CAS Name: 4-(1-hexoxyethyl)benzoic acid (2-octoxyphenyl) ester IUPAC Name: (2-octoxyphenyl) 4-(1-hexoxyethyl)benzoate Traditional Name: 4-(1-hexoxyethyl)benzoic acid (2-octoxyphenyl) ester Formula: C29H42O4 MolecularWeight: 454.64138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCC

InChI

InChI=1S/C29H42O4/c1-4-6-8-10-11-15-23-32-27-16-12-13-17-28(27)33-29(30)26-20-18-25(19-21-26)24(3)31-22-14-9-7-5-2/h12-13,16-21,24H,4-11,14-15,22-23H2,1-3H3