3-tert-butyl-3-oxidanyl-4H-isochromen-1-one

Systemtic Name: 3-tert-butyl-3-oxidanyl-4H-isochromen-1-one Openeye Name: 3-tert-butyl-3-hydroxy-isochroman-1-one CAS Name: 3-tert-butyl-3-hydroxy-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-tert-butyl-3-hydroxy-4H-isochromen-1-one Traditional Name: 3-tert-butyl-3-hydroxy-isochroman-1-one Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CC2=CC=CC=C2C(=O)O1)O

Isomeric SMILES

CC(C)(C)C1(CC2=CC=CC=C2C(=O)O1)O

InChI

InChI=1S/C13H16O3/c1-12(2,3)13(15)8-9-6-4-5-7-10(9)11(14)16-13/h4-7,15H,8H2,1-3H3