phenyl 5-[2-(4-hydroxyphenyl)octan-2-yl]-2-oxidanyl-benzoate

Systemtic Name: phenyl 5-[2-(4-hydroxyphenyl)octan-2-yl]-2-oxidanyl-benzoate Openeye Name: phenyl 2-hydroxy-5-[1-(4-hydroxyphenyl)-1-methyl-heptyl]benzoate CAS Name: 2-hydroxy-5-[2-(4-hydroxyphenyl)octan-2-yl]benzoic acid phenyl ester IUPAC Name: phenyl 2-hydroxy-5-[2-(4-hydroxyphenyl)octan-2-yl]benzoate Traditional Name: 2-hydroxy-5-[1-(4-hydroxyphenyl)-1-methyl-heptyl]benzoic acid phenyl ester Formula: C27H30O4 MolecularWeight: 418.5247

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C1=CC=C(C=C1)O)C2=CC(=C(C=C2)O)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C1=CC=C(C=C1)O)C2=CC(=C(C=C2)O)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C27H30O4/c1-3-4-5-9-18-27(2,20-12-15-22(28)16-13-20)21-14-17-25(29)24(19-21)26(30)31-23-10-7-6-8-11-23/h6-8,10-17,19,28-29H,3-5,9,18H2,1-2H3