(1S,3aS,4R,7R,8aR)-4-(hydroxymethyl)-1-methyl-7-(2-oxidanylpropan-2-yl)-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one

Systemtic Name: (1S,3aS,4R,7R,8aR)-4-(hydroxymethyl)-1-methyl-7-(2-oxidanylpropan-2-yl)-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one Openeye Name: (1S,3aS,4R,7R,8aR)-4-(hydroxymethyl)-7-(1-hydroxy-1-methyl-ethyl)-1-methyl-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one CAS Name: (1S,3aS,4R,7R,8aR)-4-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-1-methyl-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one IUPAC Name: (1S,3aS,4R,7R,8aR)-4-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-1-methyl-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one Traditional Name: (1S,3aS,4R,7R,8aR)-7-(1-hydroxy-1-methyl-ethyl)-1-methyl-4-methylol-3,3a,4,5,6,7,8,8a-octahydro-1H-azulen-2-one Formula: C15H26O3 MolecularWeight: 254.36514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC(CCC(C2CC1=O)CO)C(C)(C)O

Isomeric SMILES

C[C@H]1[C@@H]2C[C@@H](CC[C@H]([C@H]2CC1=O)CO)C(C)(C)O

InChI

InChI=1S/C15H26O3/c1-9-12-6-11(15(2,3)18)5-4-10(8-16)13(12)7-14(9)17/h9-13,16,18H,4-8H2,1-3H3/t9-,10-,11+,12-,13+/m0/s1