(1-tert-butyl-4-oxidanyl-cyclohexa-2,4-dien-1-yl) ethanoate

Systemtic Name: (1-tert-butyl-4-oxidanyl-cyclohexa-2,4-dien-1-yl) ethanoate Openeye Name: (1-tert-butyl-4-hydroxy-cyclohexa-2,4-dien-1-yl) acetate CAS Name: acetic acid (1-tert-butyl-4-hydroxy-1-cyclohexa-2,4-dienyl) ester IUPAC Name: (1-tert-butyl-4-hydroxycyclohexa-2,4-dien-1-yl) acetate Traditional Name: acetic acid (1-tert-butyl-4-hydroxy-cyclohexa-2,4-dien-1-yl) ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CC=C(C=C1)O)C(C)(C)C

Isomeric SMILES

CC(=O)OC1(CC=C(C=C1)O)C(C)(C)C

InChI

InChI=1S/C12H18O3/c1-9(13)15-12(11(2,3)4)7-5-10(14)6-8-12/h5-7,14H,8H2,1-4H3