phenyl 4,5-dioctyl-2-oxidanyl-benzoate

Systemtic Name: phenyl 4,5-dioctyl-2-oxidanyl-benzoate Openeye Name: phenyl 2-hydroxy-4,5-dioctyl-benzoate CAS Name: 2-hydroxy-4,5-dioctylbenzoic acid phenyl ester IUPAC Name: phenyl 2-hydroxy-4,5-dioctylbenzoate Traditional Name: 2-hydroxy-4,5-dioctyl-benzoic acid phenyl ester Formula: C29H42O3 MolecularWeight: 438.64198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=C(C(=C1)C(=O)OC2=CC=CC=C2)O)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C=C(C(=C1)C(=O)OC2=CC=CC=C2)O)CCCCCCCC

InChI

InChI=1S/C29H42O3/c1-3-5-7-9-11-14-18-24-22-27(29(31)32-26-20-16-13-17-21-26)28(30)23-25(24)19-15-12-10-8-6-4-2/h13,16-17,20-23,30H,3-12,14-15,18-19H2,1-2H3