(7aS)-4,7a-dimethyl-3-oxidanyl-6,7-dihydro-3H-2-benzofuran-1,5-dione

Systemtic Name: (7aS)-4,7a-dimethyl-3-oxidanyl-6,7-dihydro-3H-2-benzofuran-1,5-dione Openeye Name: (7aS)-3-hydroxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-dione CAS Name: (7aS)-3-hydroxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-dione IUPAC Name: (7aS)-3-hydroxy-4,7a-dimethyl-6,7-dihydro-3H-2-benzofuran-1,5-dione Traditional Name: (7aS)-3-hydroxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-quinone Formula: C10H12O4 MolecularWeight: 196.19988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(OC(=O)C2(CCC1=O)C)O

Isomeric SMILES

CC1=C2C(OC(=O)[C@]2(CCC1=O)C)O

InChI

InChI=1S/C10H12O4/c1-5-6(11)3-4-10(2)7(5)8(12)14-9(10)13/h8,12H,3-4H2,1-2H3/t8?,10-/m0/s1