[6,8,8-trimethyl-3-oxidanyl-2-oxidanylidene-3-(3,5,5-trimethylhexyl)nonyl] 4-oxidanylbenzoate

Systemtic Name: [6,8,8-trimethyl-3-oxidanyl-2-oxidanylidene-3-(3,5,5-trimethylhexyl)nonyl] 4-oxidanylbenzoate Openeye Name: [3-hydroxy-6,8,8-trimethyl-2-oxo-3-(3,5,5-trimethylhexyl)nonyl] 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid [3-hydroxy-6,8,8-trimethyl-2-oxo-3-(3,5,5-trimethylhexyl)nonyl] ester IUPAC Name: [3-hydroxy-6,8,8-trimethyl-2-oxo-3-(3,5,5-trimethylhexyl)nonyl] 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid [3-hydroxy-2-keto-6,8,8-trimethyl-3-(3,5,5-trimethylhexyl)nonyl] ester Formula: C28H46O5 MolecularWeight: 462.66184

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CCC(C)CC(C)(C)C)(C(=O)COC(=O)C1=CC=C(C=C1)O)O)CC(C)(C)C

Isomeric SMILES

CC(CCC(CCC(C)CC(C)(C)C)(C(=O)COC(=O)C1=CC=C(C=C1)O)O)CC(C)(C)C

InChI

InChI=1S/C28H46O5/c1-20(17-26(3,4)5)13-15-28(32,16-14-21(2)18-27(6,7)8)24(30)19-33-25(31)22-9-11-23(29)12-10-22/h9-12,20-21,29,32H,13-19H2,1-8H3