1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one

Systemtic Name: 1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one Openeye Name: 1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one CAS Name: 1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]-1-propanone IUPAC Name: 1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one Traditional Name: 1-[(1R,4S,5S)-6-methyl-3-phenyl-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one Formula: C18H25NO MolecularWeight: 271.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C2CCC(CC1C3=CC=CC=C3)CN2C

Isomeric SMILES

CCC(=O)[C@@H]1[C@@H]2CC[C@H](CC1C3=CC=CC=C3)CN2C

InChI

InChI=1S/C18H25NO/c1-3-17(20)18-15(14-7-5-4-6-8-14)11-13-9-10-16(18)19(2)12-13/h4-8,13,15-16,18H,3,9-12H2,1-2H3/t13-,15?,16+,18+/m1/s1