(3S,3aR,7aR)-4,4,7a-trimethyl-3-oxidanyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one

Systemtic Name: (3S,3aR,7aR)-4,4,7a-trimethyl-3-oxidanyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one Openeye Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one CAS Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one IUPAC Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5,6,7-tetrahydro-3H-1-benzofuran-2-one Traditional Name: (3S,3aR,7aR)-3-hydroxy-4,4,7a-trimethyl-3a,5,6,7-tetrahydro-3H-benzofuran-2-one Formula: C11H18O3 MolecularWeight: 198.25882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1C(C(=O)O2)O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C11H18O3/c1-10(2)5-4-6-11(3)8(10)7(12)9(13)14-11/h7-8,12H,4-6H2,1-3H3/t7-,8-,11+/m0/s1