2,4,4-trimethylhexyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: 2,4,4-trimethylhexyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate Openeye Name: 2,4,4-trimethylhexyl 3-(4-hydroxy-3,5-dimethyl-phenyl)propanoate CAS Name: 3-(4-hydroxy-3,5-dimethylphenyl)propanoic acid 2,4,4-trimethylhexyl ester IUPAC Name: 2,4,4-trimethylhexyl 3-(4-hydroxy-3,5-dimethylphenyl)propanoate Traditional Name: 3-(4-hydroxy-3,5-dimethyl-phenyl)propionic acid 2,4,4-trimethylhexyl ester Formula: C20H32O3 MolecularWeight: 320.46628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CC(C)COC(=O)CCC1=CC(=C(C(=C1)C)O)C

Isomeric SMILES

CCC(C)(C)CC(C)COC(=O)CCC1=CC(=C(C(=C1)C)O)C

InChI

InChI=1S/C20H32O3/c1-7-20(5,6)12-14(2)13-23-18(21)9-8-17-10-15(3)19(22)16(4)11-17/h10-11,14,22H,7-9,12-13H2,1-6H3