2H-pyran-2-ylmethyl 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: 2H-pyran-2-ylmethyl 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: 2H-pyran-2-ylmethyl 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid 2H-pyran-2-ylmethyl ester IUPAC Name: 2H-pyran-2-ylmethyl 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid 2H-pyran-2-ylmethyl ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCC2C=CC=CO2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCC2C=CC=CO2

InChI

InChI=1S/C21H28O4/c1-20(2,3)16-11-14(12-17(18(16)22)21(4,5)6)19(23)25-13-15-9-7-8-10-24-15/h7-12,15,22H,13H2,1-6H3