(3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-oxidanyl-4,5,6,6a-tetrahydropentalen-1-one

Systemtic Name: (3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-oxidanyl-4,5,6,6a-tetrahydropentalen-1-one Openeye Name: (3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-hydroxy-4,5,6,6a-tetrahydropentalen-1-one CAS Name: (3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-hydroxy-4,5,6,6a-tetrahydropentalen-1-one IUPAC Name: (3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-hydroxy-4,5,6,6a-tetrahydropentalen-1-one Traditional Name: (3aS,6S)-3-tert-butyl-3a-(dimethylamino)-6-hydroxy-4,5,6,6a-tetrahydropentalen-1-one Formula: C14H23NO2 MolecularWeight: 237.33792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)C2C1(CCC2O)N(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=O)C2[C@]1(CC[C@@H]2O)N(C)C

InChI

InChI=1S/C14H23NO2/c1-13(2,3)11-8-10(17)12-9(16)6-7-14(11,12)15(4)5/h8-9,12,16H,6-7H2,1-5H3/t9-,12?,14+/m0/s1