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4-(4-hexoxyphenyl)carbonyloxy-2-octyl-benzoic acid

4-(4-hexoxyphenyl)carbonyloxy-2-octyl-benzoic acid

Systemtic Name:4-(4-hexoxyphenyl)carbonyloxy-2-octyl-benzoic acid
Openeye Name:4-(4-hexoxybenzoyl)oxy-2-octyl-benzoic acid
CAS Name:4-[(4-hexoxyphenyl)-oxomethoxy]-2-octylbenzoic acid
IUPAC Name:4-(4-hexoxybenzoyl)oxy-2-octylbenzoic acid
Traditional Name:4-(4-hexoxybenzoyl)oxy-2-octyl-benzoic acid
Formula: C28H38O5
MolecularWeight: 454.59832
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC(=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC)C(=O)O


Isomeric SMILES

CCCCCCCCC1=C(C=CC(=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC)C(=O)O


InChI

InChI=1S/C28H38O5/c1-3-5-7-9-10-11-13-23-21-25(18-19-26(23)27(29)30)33-28(31)22-14-16-24(17-15-22)32-20-12-8-6-4-2/h14-19,21H,3-13,20H2,1-2H3,(H,29,30)


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