(3S,3aS,7aS)-3a-methyl-7a-oxidanyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one

Systemtic Name: (3S,3aS,7aS)-3a-methyl-7a-oxidanyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one Openeye Name: (3S,3aS,7aS)-7a-hydroxy-3a-methyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one CAS Name: (3S,3aS,7aS)-7a-hydroxy-3a-methyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one IUPAC Name: (3S,3aS,7aS)-7a-hydroxy-3a-methyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one Traditional Name: (3S,3aS,7aS)-7a-hydroxy-3a-methyl-3-phenyl-1,2,3,5,6,7-hexahydroinden-4-one Formula: C16H20O2 MolecularWeight: 244.3288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12C(CCC1(CCCC2=O)O)C3=CC=CC=C3

Isomeric SMILES

C[C@]12[C@@H](CC[C@]1(CCCC2=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H20O2/c1-15-13(12-6-3-2-4-7-12)9-11-16(15,18)10-5-8-14(15)17/h2-4,6-7,13,18H,5,8-11H2,1H3/t13-,15+,16-/m0/s1