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8-[4-(4-octylphenyl)phenoxy]octyl 2,5-bis(oxidanyl)benzoate

8-[4-(4-octylphenyl)phenoxy]octyl 2,5-bis(oxidanyl)benzoate

Systemtic Name:8-[4-(4-octylphenyl)phenoxy]octyl 2,5-bis(oxidanyl)benzoate
Openeye Name:8-[4-(4-octylphenyl)phenoxy]octyl 2,5-dihydroxybenzoate
CAS Name:2,5-dihydroxybenzoic acid 8-[4-(4-octylphenyl)phenoxy]octyl ester
IUPAC Name:8-[4-(4-octylphenyl)phenoxy]octyl 2,5-dihydroxybenzoate
Traditional Name:2,5-dihydroxybenzoic acid 8-[4-(4-octylphenyl)phenoxy]octyl ester
Formula: C35H46O5
MolecularWeight: 546.73674
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCCCCOC(=O)C3=C(C=CC(=C3)O)O


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCCCCOC(=O)C3=C(C=CC(=C3)O)O


InChI

InChI=1S/C35H46O5/c1-2-3-4-5-8-11-14-28-15-17-29(18-16-28)30-19-22-32(23-20-30)39-25-12-9-6-7-10-13-26-40-35(38)33-27-31(36)21-24-34(33)37/h15-24,27,36-37H,2-14,25-26H2,1H3


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