(4-tert-butyl-2,6-dimethyl-phenyl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2COC3=CC=CC=C3O2)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)[C@H]2COC3=CC=CC=C3O2)C)C(C)(C)C

InChI

InChI=1S/C22H26O4/c1-14-10-16(22(3,4)5)11-15(2)17(14)12-25-21(23)20-13-24-18-8-6-7-9-19(18)26-20/h6-11,20H,12-13H2,1-5H3/t20-/m1/s1