(3S,3aR,7aR)-4,4,7a-trimethyl-3-oxidanyl-3a,5-dihydro-3H-1-benzofuran-2-one

Systemtic Name: (3S,3aR,7aR)-4,4,7a-trimethyl-3-oxidanyl-3a,5-dihydro-3H-1-benzofuran-2-one Openeye Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5-dihydro-3H-benzofuran-2-one CAS Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5-dihydro-3H-benzofuran-2-one IUPAC Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5-dihydro-3H-1-benzofuran-2-one Traditional Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5-dihydro-3H-benzofuran-2-one Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=CC2(C1C(C(=O)O2)O)C)C

Isomeric SMILES

C[C@@]12C=CCC([C@@H]1[C@@H](C(=O)O2)O)(C)C

InChI

InChI=1S/C11H16O3/c1-10(2)5-4-6-11(3)8(10)7(12)9(13)14-11/h4,6-8,12H,5H2,1-3H3/t7-,8-,11+/m0/s1