methyl 3-[2,3-dimethyl-4-oxidanyl-5-(2,4,4-trimethylpentan-2-yl)phenyl]propanoate

Systemtic Name: methyl 3-[2,3-dimethyl-4-oxidanyl-5-(2,4,4-trimethylpentan-2-yl)phenyl]propanoate Openeye Name: methyl 3-[4-hydroxy-2,3-dimethyl-5-(1,1,3,3-tetramethylbutyl)phenyl]propanoate CAS Name: 3-[4-hydroxy-2,3-dimethyl-5-(2,4,4-trimethylpentan-2-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-hydroxy-2,3-dimethyl-5-(2,4,4-trimethylpentan-2-yl)phenyl]propanoate Traditional Name: 3-[4-hydroxy-2,3-dimethyl-5-(1,1,3,3-tetramethylbutyl)phenyl]propionic acid methyl ester Formula: C20H32O3 MolecularWeight: 320.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1CCC(=O)OC)C(C)(C)CC(C)(C)C)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1CCC(=O)OC)C(C)(C)CC(C)(C)C)O)C

InChI

InChI=1S/C20H32O3/c1-13-14(2)18(22)16(20(6,7)12-19(3,4)5)11-15(13)9-10-17(21)23-8/h11,22H,9-10,12H2,1-8H3